ライフサイエンスコーパス: coupling constant

1 state ordering, energy spacing, and magnetic coupling constant.

2 me disordered by quenching the ferromagnetic coupling constant.

3 shift values and as well as one (13)C-(77)Se coupling constant.

4 to [2Fe2S], the larger the antiferromagnetic coupling constant.

5 asurable effects on the (13)C-(13)C one-bond coupling constants.

6 conformation on vicinal phosphorus-hydrogen coupling constants.

7 coherent states, is highly sensitive to the coupling constants.

8 r Pt and N chemical shifts as well as Pt-N J-coupling constants.

9 hrough their rotational and (14)N quadrupole coupling constants.

10 , which was found to have unexpected vicinal coupling constants.

11 olecules is the ability to accurately obtain coupling constants.

12 s indicated by unexpectedly small spin-orbit coupling constants.

13 and solvent dependent isotopic shifts and HD coupling constants.

14 he torsion angles were measured by spin-spin coupling constants.

15 is discussed in detail, as are the (1)H NMR coupling constants.

16 measurements of 3J(CgammaCO) and 3J(CgammaN) coupling constants.

17 d, as determined by (1)H-(1)H and (13)C-(1)H coupling constants.

18 action and measurably larger electron proton coupling constants.

19 ned from experimentally measured (15)N-(31)P coupling constants.

20 (charge and spin) densities and the exchange-coupling constants.

21 nd allowed the measurement of (1)H hyperfine coupling constants.

22 onds indicated by the corresponding (1)J(CH) coupling constants.

23 nd accurate computations of proton spin-spin coupling constants.

24 e observed with three different (13)C-(77)Se coupling constants.

25 achieving practical evaluation of spin-spin coupling constants.

26 short H-F distance of 1.79(3) A and a large coupling constant ((1) JHF ) of 57.2 Hz.

27 ct measurement of one-bond (1)H-(17)O scalar coupling constants ((1) J(OH)) or (1)H-(17)O dipolar cou

28 Computed coupling constants ((1)J(X-H)) for monomers are in good

29 ation of experimental one-bond proton-carbon coupling constants ((1)JCH) in small molecules is presen

30 The decrease in reduced coupling constants ((1)K(X-H)) as the X-H distance incre

31 All reduced Fermi-contact terms and reduced coupling constants ((1)K(X-H)) for monomers and complexe

32 These data supplemented by diagnostic coupling constants (1h)J(NH...F(-)) give insight into ho

33 The olefinic interproton two-bond coupling constants (2)JH,H of the H2C horizontal lineCLi

34 Two-bond (13)C-(1)H NMR spin-spin coupling constants ((2)J(CCH)) between C2 and H1 of aldo

35 provide predictions of the three-bond scalar coupling constants ((3)J(H(N)H(alpha))), chemical-shift

36 ugh PSEUROT analysis of three-bond (1)H-(1)H coupling constants ((3)J(HH)) of the ring hydrogens.

37 olidine ring in each compound was gauged via coupling constants ((3)JHalpha,Hbeta) and the electroneg

38 performed to evaluate three-bond (15)N-(31)P coupling constants ((3h)J(N[bond]P)) across N[bond]H....

39 ution by comparing the vicinal proton-proton coupling constants (3J(HH)) obtained in solution to thei

40 The value of the dipolar coupling constant, 5250 +/- 90 Hz, corresponds to an ave

41 e 1 copper protein at low pH (with hyperfine coupling constant A( parallel) = 54 x 10(-4) cm(-1) at p

42 utions makes it possible to measure 3JalphaN coupling constants accurately over the full temperature

43 (13)C and (1)H chemical shifts, and (1)J(CH) coupling constants against the Charton steric parameter,

44 that electron spin resonance (ESR) hyperfine coupling constants (aH values) computed at the BLYP/EPR-

45 nd < 8 gauss changes in the copper hyperfine coupling constants (AII) in the X-band electron paramagn

46 and moiety and the (13)C isotropic hyperfine coupling constants, Aiso((13)C), for the individual carb

47 alues, and the (13)C(1)-(7)Li or (13)C-(6)Li coupling constants all increase with decreasing values o

48 ed states, and short and long-range magnetic coupling constants all indicate a rather weak interactio

49 s in conjunction with rff-computed spin-spin coupling constants allow for fast and reliable screening

50 The (13)C hyperfine coupling constants also provide an independent experimen

51 in the rest of the chain are determined from coupling constants, amide-amide sequential NOEs, seconda

52 matrix that parametrizes chemical shifts and coupling constants among spins provides a much richer fe

53 experimental (3)J(H,H) values from (1)H NMR coupling constant analyses.

54 h a combination of NOESY analysis, spin-spin coupling constant analysis, and NMR chemical shifts meas

55 ation was assigned on the basis of (1)H/(1)H coupling constant analysis.

56 (13)C RDCs measured in a PMMA gel and a (3)J coupling constant analysis.

57 mputational chemistry and (1)H NMR (3)J(H,H) coupling constant analysis.

58 fy conformational preferences primarily from coupling constant and NOE data.

59 (15)N-(29)Si coupling constants and (29)Si chemical shifts show a hig

60 with both experimentally determined (1)H NMR coupling constants and diastereoselectivity results from

61 ted from the values of the H5-H6R and H5-H6S coupling constants and found to be similar to those foun

62 The hyperfine coupling constants and geometry of the NH(2) moiety are

63 For each fragment, calculated J-coupling constants and helical propensities are in good

64 erpreted together with the (3)J(NzetaCgamma)-coupling constants and NMR-relaxation-derived S(2) order

65 y characterized by detailed 1D and 2D NMR (J-coupling constants and nOe analysis), mass, and UV spect

66 brational spectroscopy data with 3JCalphaHNH coupling constants and obtained again blends dominated b

67 ands or cofactors (assigned chemical shifts, coupling constants and peak lists) and derived data (rel

68 ecular spin-orbitals (MSOs) to the hyperfine coupling constants and the spatial distribution of the z

69 been demonstrated for the first time between coupling constants and X-H distances for different X ato

70 (13)C NMR chemical shifts, (3)J(HNH)(alpha) coupling constants, and CD ellipticities [theta(Molar)](

71 with the observed g values, ligand hyperfine coupling constants, and FTIR stretching frequencies.

72 redicting NMR chemical shifts, EPR hyperfine coupling constants, and low-energy transitions of the ab

73 MR methods including methyl chemical shifts, coupling constants, and methyl order parameters.

74 one- and two-bond heteronuclear (13)C-(77)Se coupling constants, and the changes in both the chemical

75 ) protons, the magnitude of the 3J(NH,alpha) coupling constants, and the pattern of backbone-backbone

76 ature magnetic susceptibility, EPR hyperfine coupling constants, and the results of X-ray crystal str

77 tronic heat capacity and the electron-phonon coupling constant are larger for the thiolated NPs than

78 g(y) = 1.9957, g(z) = 1.9775, and hyperfine coupling constants are A(III)(x) = |171| G, A(III)(y) =

79 tional modes and the ensuing electron-phonon coupling constants are combined with experimental measur

80 ree temperatures, and the (1)H-(13)C dipolar coupling constants are compared with those obtained for

81 The hyperfine coupling constants are consistent with a structural mode

82 In addition, quadrupole coupling constants are decreased by up to 1 MHz.

83 culations showing that the magnitudes of the coupling constants are highly dependent on both the Fe-O

84 xperimental data, and computed spin-exchange coupling constants are in accord with spectroscopic valu

85 The computed coupling constants are in reasonable agreement with the

86 a) and N(gamma) ; and (iv) The Pt-N(alpha) J-coupling constants are small in magnitude when consideri

87 These intra- and inter-vertex coupling constants are used to track the degree of stere

88 show an increase in the Cu-N superhyperfine coupling constant as the length of the oligonucleotide i

89 iations typically observed in vicinal J(H-H) coupling constants as a function of dihedral angles.

90 The small homonuclear coupling constant between H2 and H8 protons of adenine (

91 d based on the determination of the (3)J(CH) coupling constant between the fluorine-decoupled (13)CF3

92 blished by (1)H NMR, which indicated a large coupling constant between vicinal carbinol protons.

93 he quantum-mechanical level yielded one-bond coupling constants between 230 and 260 kHz.

94 nd from an acetylene C-H, as revealed by NMR coupling constants between alkyne 13C and 1H nuclei as w

95 d experiments confirmed that the vibrational coupling constants between i, i + 1 and i, i + 2 residue

96 The NMR spectra, and in particular the coupling constants between the alpha-hydrogen atom of th

97 re determined from the vicinal proton-proton coupling constants between the hydrogen nuclei of the CH

98 Calculation of phosphorus-hydrogen coupling constants both as a function of PYCH dihedral a

99 ints on the relative amplitudes of hyperfine coupling constants, both for protons at chemically disti

100 The observed quadrupolar coupling constant C(Q) of 10.5 +/- 1.5 MHz and chemical

101 lied to characterize the nuclear quadrupolar coupling constants (C(Q)) and asymmetry parameters (eta(

102 he extracted values of the (55)Mn quadrupole coupling constant, C(Q), and its asymmetry parameter, et

103 The analysis of the corresponding coupling constants calculated using DFT/B3LYP/pcJ-1 appr

104 e temperature dependence of the HD spin-spin coupling constant can be determined with standard quantu

105 based nuclear Overhauser effect and scalar J-coupling constants can provide useful spatial informatio

106 to electron paramagnetic resonance hyperfine coupling constants, can now be calculated for nitrosyl h

107 The C[bond]N coupling constants centered at the C(epsilon 1) and C(de

108 n with calculated and experimental (1)H-(1)H coupling constants comparison.

109 Coupling constants computed at the density functional th

110 Moreover, the 19F hyperfine coupling constants computed with the MP2 method and a hi

111 es), reorganization energies, and electronic coupling constants, concluding that the forward and futi

112 oadipic acid unit shows patterns of NOEs and coupling constants consistent with a well-defined turn c

113 e compounds also exhibit chemical shifts and coupling constants consistent with the formation of fold

114 lculations of (13)C chemical shifts and spin coupling constants constitute a robust and now practical

115 Time-varying coupling constants could be quantitatively determined by

116 electric field gradient (EFG) or quadrupole coupling constant (Cq) for CAII are independent of pH wi

117 The value of the quadrupole coupling constant, Cq, for the zinc increased monotonica

118 The quadrupole coupling constants, Cq's, ranged from 3.25 to 16.7 MHz t

119 assigned taking into consideration the usual coupling constants criteria, but a diagnostic based on t

120 igma of PII nucleation is evaluated from the coupling constant data.

121 ed and well simulated using distinct dipolar coupling constants DCalphaH and DCalphaD for the enantio

122 For the donor C-C bond, coupling constants decrease, consistent with weakening o

123 In addition, scalar coupling constants derived from simulations in the TIP4P

124 The (1h)J(2'OH,N) cross hydrogen bond scalar coupling constant determined from a quantitative 1D (15N

125 distribution, geometrical parameters, and J-coupling constant differences between canonical and Lewi

126 for the helix dimers from an analysis of the coupling constant distribution.

127 ior of the (1)J(CF) rotational profile, this coupling constant does not appear to be of significant d

128 fin strain energies, NMR chemical shifts and coupling constants (DU8+).

129 e could, in principle, depend on the reduced coupling constant epsilon0 of the initial state and the

130 Quadrupole coupling constants estimated from (14)N HYSCORE spectra

131 The (1)J(NC') coupling constant for the (-1) scissile peptide bond at

132 X-ray structures, together with (1)H NMR coupling constants for [2](2+), indicate geometries in w

133 (1)H-(13)C/(1)H-(15)N heteronuclear dipolar coupling constants for CAP-Gly and CTD CA, reporting on

134 compared to the corresponding theoretical J coupling constants for cases where (1) there is an absen

135 al shifts and (1)H-(1)H and (13)C-(13)C spin-coupling constants for cis and trans amides that are det

136 ferent X atoms by plotting the ratios of the coupling constants for complexes and corresponding monom

137 Electronic coupling constants for Dexter transfer were determined t

138 ccur in the amide one-bond (15)N-(1)H scalar coupling constants for glutamine binding protein (GlnBP)

139 at ff99SB demonstrates poor agreement with J-coupling constants for short polyalanines.

140 rfine couplings; the differences between the coupling constants for the buried and solvent-exposed ra

141 Calculated magnetic coupling constants for the carboxylate-bridged structure

142 Isotropic hyperfine coupling constants for the ligand nitrogen atoms were al

143 DFT calculations of isotropic shieldings and coupling constants for the set of low-energy conformatio

144 l t-CHP ring and the observed NMR shifts and coupling constants for the system.

145 rter computational times: accurate spin-spin coupling constants for the two conformers of strychnine

146 Dihedral scalar coupling constants for the wild-type IL-1beta and the fo

147 y are both accounted for, the J((11)B,(11)B) coupling constants for various [B2(CN)6](2-) salts were

148 The quadrupole coupling constants for weakly coupled nitrogens determin

149 nd (1)H(OH)-chemical shifts and vicinal spin-coupling constants) for contiguous polyols are reported.

150 We show that the triple product of the coupling constant [Formula: see text], seed pulse durati

151 t determination of accurate residual dipolar coupling constants from a single NMR spectrum.

152 e ab initio or DFT calculations of spin-spin coupling constants have been very challenging and expens

153 e reported and their isotropic 19F hyperfine coupling constants (hfcc) of 198.6 +/- 0.4 G, 147.6 +/-

154 The hyperfine coupling constants (HFCs) determined from the well-resol

155 reasing temperature of the one-bond 13C, 6Li coupling constant in 6, 7, and 13 provided the dynamics

156 The allosteric coupling constant in K-type allosteric systems is define

157 Spin-spin coupling constants in (1)H NMR carry a wealth of structu

158 nd electron paramagnetic resonance hyperfine coupling constants in a model Fe(II)(NO)(imidazole) comp

159 (1)H, (15)N-(1)H, (17)O-(1)H, and (19)F-(1)H coupling constants in a systematic study of monomers and

160 e magnitudes of the one-bond (13)C,(6)Li NMR coupling constants in combination with lithiation NMR sh

161 rom a combination of homo- and heteronuclear coupling constants in conjunction with molecular modelin

162 We next addressed one-bond NMR coupling constants in ethers and the reverse anomeric ef

163 tudied systems, the numerical approach gives coupling constants in excellent agreement with the avail

164 and accurate measurement of proton-fluorine coupling constants in fluorinated organic compounds.

165 H-(1)H, (13)C-(1)H, and (13)C-(13)C NMR spin-coupling constants in four model compounds that mimic al

166 g pseudopotentials to calculate the exchange coupling constants in four polynuclear first-row transit

167 lectronic interactions in (1)J(C-H) one-bond coupling constants in six-membered rings, (3) eclipsed c

168 e compare the NMR indirect nuclear spin-spin coupling constants in strychnine calculated using densit

169 nsideration of homonuclear and heteronuclear coupling constants in tandem with ROESY data.

170 ling enables the visualization of unresolved coupling constants in the acquisition dimension of one-d

171 Isotopic enrichment and (13)C-(13)C coupling constants in the aromatic ring of the isolated

172 shifts in the IR spectra and (13)C hyperfine coupling constants in the EPR spectra exhibit good agree

173 cements in BaTiO(3) produces on the exchange coupling constants in the interfacial-oxidized Fe layer.

174 Analysis of the 5J(HH) and 3J(13C-H) coupling constants in the NMR spectra showed an anti add

175 magnetic susceptibility data yield exchange coupling constants in the range J = 17.0-17.6 cm(-1).

176 For example, the J(HSi) coupling constants in these species range in value from

177 Most importantly, (1)H-(19)F coupling constants in this series are among the largest

178 of this bond, while the intervening C-C bond coupling constants increase, consistent with bond streng

179 c effects upon (13)C NMR chemical shifts and coupling constants indicate that increasing the bulk of

180 y revealed a 9-line spectrum, with hyperfine coupling constants indicative of four almost magneticall

181 (NOEs), hydrogen-bonding networks, 3J(HNHA) coupling constants, intermolecular NOEs, and residual di

182 J(CH) and J(CC) spin-spin coupling constants involving the labeled anomeric carbon

183 luoroethane and fluoro(methoxy)methane, this coupling constant is at least not exclusively dependent

184 The larger coupling constant is indicative of weaker H-bonding that

185 As a result, the coupling constant is itself an equilibrium value compris

186 n of a temperature-dependent electron-phonon coupling constant is necessary to adequately fit the dyn

187 these values and suggested that the smaller coupling constant is negative.

188 when a sufficient number of residual dipolar coupling constants is measured, the outcome is a robust,

189 Electric charge (the gauge coupling constant) is energy dependent, and there is a p

190 a training set of 475 experimental spin-spin coupling constants, is developed for hydrogen and common

191 he determination, especially of small scalar coupling constants, is often prevented by merging the sp

192 " hydrogen bond is investigated through NMR (coupling constants, isotopic chemical shift perturbation

193 The exchange-coupling constant J (Hex = JS1.S2) was found to increase

194 temperature dependent) of the H-D spin-spin coupling constant J(HD) for six transition metal hydride

195 distances (2.00(4) - 2.09(4) A) and average coupling constant (J(SiH) = 25 Hz) suggest some degree o

196 pling and thereby a higher magnetic exchange coupling constant (J).

197 calculations that stress the role of scalar coupling constants (J(HN) and J(HH)) and of the field de

198 d to the appearance of long-range (1)H-(15)N coupling constants (J(HN)), which can be measured easily

199 -bond 199Hg-199Hg nuclear magnetic spin-spin coupling constants (J-couplings) of [Hg-Hg-Hg]2+ were ca

200 The exchange coupling constants (|J/k|) are of the order of 1 K.

201 m radical anion allows the magnetic exchange coupling constant, J(Gd-rad), for the gadolinium compoun

202 te that inhibitor binding decreases the spin-coupling constant, J, compared to the native enzyme.

203 13C-13C Spin-spin coupling constants (JCC) have been measured in a group o

204 ne and pentane between 296 and 213 K exhibit coupling constants JHD of 3.8-9.0 Hz, suggesting the pre

205 Electron-phonon coupling constant lambda and electronic density of state

206 on strong coupling superconductivity with a coupling constant lambda ~ 2.

207 c about infinity and contain a dimensionless coupling constant M/s, where M denotes the total mass-en

208 ng an S = 7/2 ground state with an estimated coupling constant magnitude of |J| >/= 900 cm(-1).

209 point calculations predict small spin-orbit coupling constants making the spin state change from low

210 3J(NP) coupling constant measurements using quantitative J-corr

211 ons of the meroterpenoids were determined by coupling constant, NOE, and Mosher's analysis.

212 (obs) represents the proton-fluorine vicinal coupling constant observed at the midpoint of an acid-ba

213 spectrum, which yielded a (65)Cu quadrupole coupling constant of +/-71.2 +/- 1 MHz, corresponding to

214 effect on warfarin/HSA binding, providing a coupling constant of 0.79 (+/-0.03).

215 c(4)O(2)@C(80) exhibited an especially large coupling constant of 150.4 G in the cation radical, whic

216 ic effect on tamoxifen/HSA binding, giving a coupling constant of 2.3 (+/-0.3).

217 pposite the indene moiety, gave a long-range coupling constant of 4J(Me,H) = 1.3-1.4 Hz.

218 pled nonexchangeable proton with a hyperfine coupling constant of 50 MHz.

219 signal with a g value of 2.003 and hyperfine coupling constant of 8 x 10(-4) cm(-1) to the I = 7/2 (5

220 nated apatite are similar but the quadrupole coupling constant of cortical bone is larger than that m

221 The one-bond 13C-1H spin-spin coupling constant of hexafluoroisopropanol (HFIP) correl

222 gnetic coupling between iron centers, with a coupling constant of J = +110(12) cm(-1), to give an S =

223 tween the two S = 1/2 Cu(II) centers, with a coupling constant of J = +2.69(5) cm(-1), to give an S =

224 gnetic exchange between spin centers, with a coupling constant of J = -122(2) cm(-1).

225 arises from the S = 2 manifold, an exchange coupling constant of J = -2.7 +/- 0.2 cm(-)(1) (H(ex) =

226 ta = -125 K, and a nearest-neighbor exchange coupling constant of J(NN) = -12.5 K are observed.

227 exhibits a record antiferromagnetic exchange coupling constant of J(V-Mo) = -114 cm(-1).

228 The hyperfine coupling constant of the g = 2 signal in the EPR spectra

229 constant E(T)(N) and the nitrogen hyperfine coupling constant of the released nitroxide a(N,SG1), me

230 pictures of the dependence of the hyperfine coupling constant of the trapped H atom upon the detrapp

231 are created by a giant Rashba effect with a coupling constant of ~4 eV.A due to interfacial charge t

232 ground state with isotropic (55)Mn hyperfine coupling constants of -75, -88, -91, and 66 MHz.

233 luster is highly anisotropic, with hyperfine coupling constants of 9.1 and 2 x 33.3 G for the [5,6] a

234 Experimental quadrupolar coupling constants of alpha deuterons (D(alpha) QCC) are

235 se Perlin effect was observed on the (1)JC-F coupling constants of alpha- and beta-d-glucopyranosyl f

236 modes to be 11.5 and 15.3 meV, and Frohlich coupling constants of approximately 40 and 60 meV for th

237 identical PNCH dihedral angles but measured coupling constants of approximately 6 and 1.5 Hz.

238 A diagnostic trend for coupling constants of gamma-benzyloxy beta-lactones was

239 The (3)J(HN alpha) coupling constants of individual alanine residues have b

240 iferromagnetic metal...radical coupling with coupling constants of J = -67.5 and -66.8 cm(-1) for 1 a

241 of apparent DeltaG values from the measured coupling constants of the backbone amides, we can constr

242 l and constraints imposed by the 3JCalphaHNH coupling constants of the central residues to simulate t

243 A comparison of g tensors and (1)H hyperfine coupling constants of the PTB7-type oligomers with the h

244 and (3)J(A) are the proton-fluorine vicinal coupling constants of the standard acid and its anion, r

245 nship between the difference in the (1)J(CH) coupling constants of the two competing allylic C-H bond

246 The J((11)B,(11)B) coupling constants of various salts of the electron-prec

247 (chemical shifts, chemical shift dispersion, coupling constants) of molecules free in solution, in co

248 Since the ratio removes the dependence of coupling constants on the magnetogyric ratios of X, this

249 substrate, corresponding to magnetoelectric coupling constants on the order of alpha = (2-5) . 10(-7

250 On the basis of the quadrupole coupling constant, one nitrogen can only be assigned to

251 different types of long-range (15)N-(13)C J-coupling constants: one between intraresidue (15)Nzeta a

252 de S-N bond, and vicinal phosphorus-hydrogen coupling constants over 40 Hz.

253 The coupling constant perturbations correlate with significa

254 description of adiabatic dynamics, where the coupling constant plays the role of time and the counter

255 the original structures, the calculated spin coupling constants possess much higher structural inform

256 ne (1)H NMR chemical shifts, and large J(CH) coupling constants provide evidence for donation of elec

257 nalysis of the boron and nitrogen quadrupole coupling constants provided the valence p-electron occup

258 on zeolite HZSM-5, calculated the quadrupole coupling constants (Q(cc)) and asymmetry parameters (eta

259 on on allostery is to monitor the allosteric coupling constant (Qax), a ratio of the substrate bindin

260 quadrupolar coupling parameters (quadrupolar coupling constant, QCC, and asymmetry parameter, eta) fo

261 ts yield an average value of the quadrupolar coupling constant, QCC, for D(alpha) sites in proteins e

262 n techniques with regard to chemical shifts, coupling constants, relaxation rates and nuclear Overhau

263 The sign of the coupling constant remained consistent for larger label s

264 143 ((1)J) experimental (13)C-(1)H spin-spin coupling constants reported in the literature.

265 the (14)N hyperfine coupling and quadrupole coupling constants reported previously using HYSCORE spe

266 nd (15)N chemical shifts as well as (1)J(NH) coupling constants revealed for DSI/imine complexes ion

267 ermined through the use of vicinal 119Sn-13C coupling constants, revealing a conformational distortio

268 frequency and the imidazole (14)N hyperfine coupling constants show a good correlation with the Fe-(

269 The coupling constants show that for each of the indicated r

270 Calculations of scalar (J) coupling constants showed the best agreement with experi

271 s, the 15N chemical shift and 15N-1H dipolar coupling constants, showed semi-quantitative agreement w

272 sed hyperfine structure with large hyperfine coupling constants shows that both oxidation and reducti

273 curate prediction of proton-proton spin-spin coupling constants (SSCC) in (1)H NMR.

274 curate prediction of proton-proton spin-spin coupling constants (SSCC) in (1)H NMR.

275 a lone pair effect on (3)J(PH), the negative coupling constant, temperature-dependent chemical shifts

276 cal structure that predicts residual dipolar coupling constants that are incompatible with those meas

277 s was investigated using (3)JH,H and (3)JC,H coupling constants that were determined from 1D (1)H NMR

278 ndependent of [Formula: see text], the gauge-coupling constant, the Fermi velocity, the Fermi surface

279 A large quadrupolar coupling constant, the measure of the local distortion o

280 On the basis of NMR coupling constants, the originally formed ring-opened in

281 addition to the most commonly used (3) J(CH) coupling constants, the subset of 32 (2) J(CH) values al

282 resolved are available to obtain complicated coupling constants; the multiple homonuclear decoupling

283 These are commonly observed, but the coupling constants thus obtained are invalid for data-st

284 (2)J(CH), (3)J(CH), and (4)J(CH) coupling constants to (19)F decoupled CF3 groups in alke

285 We present a method to use long-range CH coupling constants to derive the correct diastereoisomer

286 hich exhibit a change in their EPR hyperfine coupling constants upon enzymatic activity and are selec

287 Monitoring either chemical shift or coupling constant versus THF concentration even in the h

288 elated HSQC NMR spectroscopy, and the 15N-1H coupling constant was found to be 1.8 Hz greater for the

289 ntal evidence of the opposite signs of these coupling constants was obtained by analysis of the ABX N

290 ng a free-ion value for the Pu(4+) hyperfine coupling constant, we estimated a bare (239)gamma(n)/2pi

291 In addition, scalar coupling constants were computed at TPSS-D3/IGLO-III.

292 cals, muon, proton, and phosphorus hyperfine coupling constants were determined by muSR and compared

293 es in both the chemical shift values and the coupling constants were found to obey linear free energy

294 The coupling constants were found to strongly correlate to t

295 ng DFT calculations, the predicted hyperfine coupling constants were used to simulate the EPR spectra

296 Magnitudes of the quadrupole coupling constants, which are proportional to the electr

297 h different substrates, as did mitochondrial coupling constants, which were significantly larger for

298 imulations reveal antiferromagnetic exchange-coupling constants with an average of 2.1 K within the {

299 ise ratio, and over a wide range of one-bond coupling constants, without the need for broadband (13)C

300 examined in terms of the role of spin-orbit coupling constants (zeta), paramagnetism, and steric eff