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1 igand efficiency (0.45-0.50 kcal/mol per non-hydrogen atom).
2 the unavailability of a syn-periplanar beta-hydrogen atom.
3 the central B-B bond is bridged by a single hydrogen atom.
4 hrough the abstraction of a target substrate hydrogen atom.
5 operties are expected to mirror those of the hydrogen atom.
6 a ligand efficiency of 0.34 kcal/mol per non-hydrogen atom.
7 or of radical species and a chiral source of hydrogen atoms.
8 tible with carboxylic acids containing alpha-hydrogen atoms.
9 a large exospheric cloud composed mainly of hydrogen atoms.
10 after saturating the nanowire sidewall with hydrogen atoms.
11 cal conductance and the adsorption energy of hydrogen atoms.
12 g as both a photoreductant and the source of hydrogen atoms.
14 mplex enzyme that led us to identify (1) the hydrogen atoms abstracted from the substrate by the two
15 ters that enables 1e(-) activation of O2 for hydrogen atom abstraction (HAA) of substrate C-H bonds a
16 understanding the basis for the high rate of hydrogen atom abstraction (HAT) from dihydroanthracene (
17 retro-Bergman ring opening predominates over hydrogen atom abstraction (k-1 > k2) for 6,7-diethynylqu
18 the thermodynamic unfavorability of both its hydrogen atom abstraction and oligomerization reactions
19 inglet oxygen scavenging, electron transfer, hydrogen atom abstraction and radical adduct formation.
20 s in ((iPr)PDI)Mo(NH3)2(eta(2)-C2H4) enabled hydrogen atom abstraction and synthesis of a terminal ni
21 gma*z(2) excitation energy, which raises the hydrogen atom abstraction barrier above that found for t
22 te hexahydrate is described as a convenient, hydrogen atom abstraction catalyst that can mediate fluo
25 an that of 1, possibly due to intramolecular hydrogen atom abstraction from benzylic methyl groups in
27 rmal conditions, the benzyl radicals undergo hydrogen atom abstraction from dibenzyl ketone and para-
28 uces vinyl radical intermediates that affect hydrogen atom abstraction from DNA, leading to the forma
30 n its chemistry than previously anticipated: hydrogen atom abstraction from Nalpha-cyclopropyltryptop
34 idence suggests DNA cleavage is initiated by hydrogen atom abstraction from the deoxyribose backbone.
35 hanisms as well as the proposal that initial hydrogen atom abstraction from the fatty acid is the fir
36 eration of the purine radical resulting from hydrogen atom abstraction from the N6-amine of 2'-deoxya
38 xperimental/theoretical study suggested that hydrogen atom abstraction in TAA by DPPH was located on
40 be intercepted at the 5-exo stage via either hydrogen atom abstraction or C-S bond scission or allowe
42 nism for the reaction that is initiated by a hydrogen atom abstraction reaction, which enables a keto
46 e decomposition via intra- or intermolecular hydrogen-atom abstraction (HAA) from an imido aryl ortho
49 ever, that are associated with variations in hydrogen-atom abstraction barrier heights and tunneling
50 iates play a major role and are generated by hydrogen-atom abstraction from substrate C-H bonds or in
51 s the origin of the reactivity preference of hydrogen-atom abstraction over nucleophilic addition.
55 er from TEMPOH, but is an intrinsically poor hydrogen atom abstractor (BDFE(OH) of 77.2 kcal/mol) bas
60 astic tunneling probe reveals the sharing of hydrogen atoms among multiple centers in intramolecular
61 the photoinduced isomer the distance between hydrogen atom and carbon atom to which it migrates in th
63 ple cubic like phosphorus layers capped with hydrogen atoms and layers of H2 molecules, are predicted
64 copy to directly observe surface adsorbates, hydrogen atoms and methyl groups, chemisorbed to the nan
65 ances to bonding contacts between the methyl hydrogen atoms and the ortho carbon atom C(o) well below
66 experiments show dramatic rate variations in hydrogen-atom and oxygen-atom transfer reactions, with f
67 allows the visualization of the positions of hydrogen atoms, and computation to characterize the cata
68 olving the transfer of a hydride ion or of a hydrogen atom are predicted to proceed through higher en
70 ructure of H3 S, and suggest that the A site hydrogen atoms are most likely fluxional even at Tc .
71 functional theory calculations indicate that hydrogen atoms are present in LnBCO as bound to oxygen f
73 cron (Bt) catalyzes abstraction of the pro-S hydrogen atom, as evidenced by the transfer of deuterium
74 ly, when the nitrogen-atom substituent was a hydrogen atom, as in 2d, 4, and 6, the nitrogen atom was
77 ,beta-unsaturated aldehyde, which contains a hydrogen atom at the gamma position, an amine-aldehyde-d
78 nol, products formed from abstraction of the hydrogen atoms at C-9 and C-14 (H-9 or H-14 mechanism) w
79 toms of the catalyst phosphate group and the hydrogen atoms at N and C2 of the substrate indole group
81 yadenosyl radical; this radical can abstract hydrogen atoms at unreactive positions, facilitating the
82 ylalanine, chlorine was found to replace one hydrogen atom attached to the aliphatic nitrogen; in the
84 predict the Volmer-Tafel mechanism in which hydrogen atoms bound to molybdenum and sulfur sites reco
86 deuterium, while replacing the transferring hydrogen atom by a methyl group makes the substrate inac
87 fect for the replacement of the transferring hydrogen atom by deuterium, while replacing the transfer
88 s observed upon substituting the transferred hydrogen atoms by deuterium, indicating that the process
90 ity phase boundaries provide a great deal of hydrogen atoms diffusion channels and nucleation sites o
91 olate along the Cl-Os-CPh axis of 2 with the hydrogen atom directed to the alkylidyne leads to alkyny
92 along the X-Os-CPh axis of 2 and 5 with the hydrogen atom directed to the halide gives the alkynyl-t
93 h pyrylium oxygen, while 3-OH group improved hydrogen atom donation because of the stabilization by a
95 was carried out in the presence of the good hydrogen atom donor alpha-tocopherol, the oxysterol prof
96 O)n shows that this reagent is a very strong hydrogen atom donor as well as an outer-sphere reductant
97 out to investigate how chloroform acts as a hydrogen atom donor in Barton reductive decarboxylations
102 dinium tetrafluoroborate and thiophenol as a hydrogen-atom donor furnished the nitrogen-containing he
104 rdinate ((Ar) L)Fe(kappa(2) -N,O-AZADO) with hydrogen atom donors yields ferric hydroxide ((Ar) L)Fe(
106 titatively determine the surface coverage of hydrogen atoms during nanowire growth by comparing nu(Ge
108 tical studies favor a pro-S abstraction of a hydrogen atom followed by the rebinding of an OH group.
109 xyadenosyl radical-mediated abstraction of a hydrogen atom from a solvent-exchangeable position as a
111 lytic mechanism begins with abstraction of a hydrogen atom from C-4 (or possibly C-3) initiating the
112 hus directing it to exclusively abstract the hydrogen atom from Fe-OH, thereby forming Cpd I, while p
115 CdSe QD plays a key role by abstracting the hydrogen atom from the C-H bond of the alcohol (R(1) CH(
116 ntal step(s) of initial transfer of a formal hydrogen atom from the SmI2-water reagent system to prod
118 nitrene moiety to phosphines and abstract a hydrogen atom from weak C-H bonds, leading to the format
119 e (S = 1) intermediate initially abstracts a hydrogen atom from, or adds nitrene to, C-H and C horizo
121 nts activate this cluster for abstraction of hydrogen atoms from an additional equivalent of PhNHNHPh
123 id alteration, the mere removal of a pair of hydrogen atoms from juxtaposed cysteine residues, contra
124 fler-Freytag reaction-amidyl radicals remove hydrogen atoms from unactivated aliphatic C-H bonds.
127 more difficult because one of the methylene hydrogen atoms (Hb) has its BDE lowering within the seri
128 ents as well as partial H/D exchange for the hydrogen atom in the ortho position of pyridine and conc
129 ce for substrates that have the transferring hydrogen atoms in close proximity, such as ortho-tetrach
131 us atoms in the equatorial positions and two hydrogen atoms in the axial positions (I4/mmm and 2FU-C2
133 xygen vacancy exchange diffusion with oxygen/hydrogen atoms in the LnBCO thin films is taking the lay
134 n which even the arrangement of the pyrrolic hydrogen atoms in the neighbouring molecule influences t
135 ents include variants in which the number of hydrogen atoms in the reactant pair and in the resulting
136 the distribution and dynamical transport of hydrogen atoms in the terrestrial atmosphere have long-s
139 d in these experiments showed that the pro-R hydrogen atom is abstracted from C-7' of undecylprodigio
141 concomitant with the transfer of the second hydrogen atom, is the rate-limiting step, with a compute
143 ts, is developed for hydrogen and common non-hydrogen atoms (Li, B, C, N, O, F, Si, P, S, Cl, Se, Br,
144 ty contrasts with the typical description of hydrogen atom-like states (S, P, etc.) in the conduction
145 t as a catalyst for the recombination of the hydrogen atoms made via the reduction of protons on the
148 shown here to demonstrate that the 6'-pro-R-hydrogen atom of GenX2 is stereoselectively abstracted b
149 rogen-bonding interaction formed between the hydrogen atom of the alpha-methylbenzylamine and the car
150 educed efficiency, suggesting that the pro-S hydrogen atom of the normal cysteinyl substrate is stere
151 and-ligand bifunctional mechanism, where two hydrogen atoms of CH3OH eliminate to the ligand's N and
153 not explicitly require chemical exchange of hydrogen atoms of parahydrogen and the substrate, the pa
158 molecules due to positively charged terminal hydrogen atoms on the diamondoid interacting with the to
160 involving reversible storage and release of hydrogen atoms on the Ru/C12A7:e(-) surface is proposed
161 ation approach utilizing a new basis set for hydrogen atoms optimized in conjunction with (i) inexpen
162 Compound I can either (i) abstract an O-H hydrogen atom or (ii) be attacked by a nucleophilic hydr
163 ters investigated reveals the preference for hydrogen atom or proton abstraction in photoreactions an
166 unction by cycling between GTP and GDP, with hydrogen atoms playing an important role in the GTP hydr
167 uctures (0.9 A resolution or better) and the hydrogen atom positions in these structures were determi
168 eory calculations, we have demonstrated that hydrogen atoms preferentially occupy substitutional posi
171 ent protein family, showed a distribution of hydrogen atoms revealing protonation of the chromophore
172 is-HCCHBS intermediate either isomerizes via hydrogen atom shift from the carbon to the boron atom, l
173 mation and subsequent trapping with either a hydrogen atom source (PhSiH3 ) or an electron-deficient
174 orocarbinyl radical, reduction of which by a hydrogen atom source gives the alkyl chloride product.
175 lectron reductant, flavin semiquinone as the hydrogen atom source, and the enzyme as the source of ch
177 Here we report the existence of non-thermal hydrogen atoms that are much hotter than the ambient oxy
178 (i) it is the carbinol C-H and adjacent O-H hydrogen atoms that are transferred during this process
179 ydroxide minerals often possess out-of-plane hydrogen atoms that form hydrogen bonding networks which
180 c process in which an alkene with an allylic hydrogen atom (the ene donor) reacts with a second unsat
182 ch are initiated by the formal addition of a hydrogen atom to a C[double bond, length as m-dash]C dou
184 decay suggests that it abstracts a substrate hydrogen atom to initiate fatty acid decarboxylation.
185 en to hydrogen bond distance positioning the hydrogen atom towards the flavin N5 reactive center.
186 y 150, associated with an intramolecular 1,5-hydrogen atom transfer (1,5-HAT) in the decay of a PEGyl
187 sition of the radical via intramolecular 1,5-hydrogen atom transfer (1,5-HAT) that was observed in it
188 iabatic reactions, which are associated with hydrogen atom transfer (HAT) and electron-proton transfe
189 ates selective C-H functionalization via 1,5-hydrogen atom transfer (HAT) and enables net incorporati
190 rough the combination of photoredox-mediated hydrogen atom transfer (HAT) and nickel catalysis, we ha
193 quinolinium, and isoquinolinium salts under hydrogen atom transfer (HAT) conditions, and an expanded
194 ic O-H of 1 and 2 from attack by CumO(*) and hydrogen atom transfer (HAT) exclusively occurs from the
197 ysis study on the role of solvent effects on hydrogen atom transfer (HAT) from the C-H bonds of N,N-d
199 magnitude decrease in the rate constant for hydrogen atom transfer (HAT) from the C-H bonds of these
201 lace through an apparent initial outersphere hydrogen atom transfer (HAT) from the Ni(II)-S(H(+))-Cys
202 ing scission experiments are consistent with hydrogen atom transfer (HAT) generation of a carbon-cent
204 indicates that these reactions proceed by a hydrogen atom transfer (HAT) mechanism where the N-oxyl
205 bond dissociation enthalpy (BDE2) related to hydrogen atom transfer (HAT) mechanism, and the second e
206 m in the substrate to accelerate the desired hydrogen atom transfer (HAT) over competing pathways.
207 and gamma-CDs favors the intramolecular 1,8-hydrogen atom transfer (HAT) promoted by the 6(I)-O-yl r
208 effect of trifluoroacetic acid (TFA) on the hydrogen atom transfer (HAT) reactions from 1,n-alkanedi
209 in regioselectivity has been observed in the hydrogen atom transfer (HAT) reactions from 4-alkyl-N,N-
214 standing chemical reactivity in general, and hydrogen atom transfer (HAT) reactivity in particular.
216 trast with the usual reactivity of TEMPOH by hydrogen atom transfer (HAT) to a single e(-)/H(+) accep
217 ito cycloaromatization (M-S), intramolecular hydrogen atom transfer (HAT), and recombination of the r
218 t of (tpfc)Mn(V)(O) in three reaction types: hydrogen atom transfer (HAT), electron transfer (ET), an
219 which the aryl radical translocates via 1,5-hydrogen atom transfer (HAT), forming a tertiary alkyl c
220 ynamic and mechanistic investigations of the hydrogen atom transfer (HAT), radical adduct formation (
221 s rapidly with a panel of substrates via C-H hydrogen atom transfer (HAT), reducing 1 to [(PyPz)Fe(II
222 s and trimers of PCs was studied through the hydrogen atom transfer (HAT), sequential proton-loss ele
223 a variety of widely available ethers through hydrogen atom transfer (HAT), were coupled with a range
225 we present a direct observation of a double hydrogen atom transfer (tautomerization) within a single
226 desaturase systems proceed through stepwise hydrogen atom transfer at physiological temperature; how
227 rategy, we herein report photoredox-mediated hydrogen atom transfer catalysis for the selective activ
230 ments rule out the alternative hypothesis of hydrogen atom transfer from a redox-active beta-diketona
231 that benzoyl-CoA reduction is initiated by a hydrogen atom transfer from a W(IV) species with an aqua
234 radicals occurs via a solvent proton-coupled hydrogen atom transfer from the substrate that has not b
235 est that this reaction is made possible by a hydrogen atom transfer from water that generates a Pd-hy
237 pectroscopic measurements revealed efficient hydrogen atom transfer from xanthene, 9,10-dihydroanthra
239 ed that from the thermodynamic point of view hydrogen atom transfer is the preferred mechanism in the
243 ctivity is controlled by the predominant 1,5-hydrogen atom transfer of an amidyl radical generated in
245 The formation of the THP involves a 1,5-hydrogen atom transfer process, leading to a diradical i
248 in we demonstrate that a photoredox-mediated hydrogen atom transfer protocol can efficiently and sele
249 he molecular motion, thereby suppressing the hydrogen atom transfer reaction to the photo-excited 24-
251 s cluster with alkenes results in oxygen and hydrogen atom transfer reactions to form alcohol- and ke
252 igated the kinetics of novel carbon-to-metal hydrogen atom transfer reactions, in which homolytic cle
253 on experiments, kinetic isotope effects, and hydrogen atom transfer reagent substitution, and via the
255 alt bis(acetylacetonate) is shown to mediate hydrogen atom transfer to a broad range of functionalize
256 The transformation connects metal-mediated hydrogen atom transfer to alkenes and Minisci addition r
258 TP to trap the GTP C3' radical, generated by hydrogen atom transfer to the 5'-deoxyadenosyl radical,
259 his study with those previously reported for hydrogen atom transfer to the cumylperoxyl radical indic
260 , as evidenced by an assay based on phenolic hydrogen atom transfer to the stable free radical DPPH.
262 of the major antioxidative mechanisms: HAT (Hydrogen Atom Transfer), SPLET (Sequential Proton-Loss E
264 ansition-metal-catalyzed C-H activation, 1,n-hydrogen atom transfer, and transition-metal-catalyzed c
266 c hypothesis characterized by intramolecular hydrogen atom transfer, radical fluorination, and ultima
267 monstrate that benzyl alcohol intercepts, by hydrogen atom transfer, the benzoylperoxy radicals that
270 catalytic processes-photoredox, enamine and hydrogen-atom transfer (HAT) catalysis-enables an enanti
271 rived nitrogen-centered radicals mediate 1,6-hydrogen-atom transfer (HAT) processes to guide gamma-C(
272 -deficient alkenes can be terminated by both hydrogen-atom transfer and single-electron reduction fol
275 d N-terminal amino group in combination with hydrogen-atom transfer from the Calpha positions of the
276 tep in the reaction cycle and is followed by hydrogen-atom transfer from the CE1-H group of trimethyl
277 acting as a H-bonding acceptor to facilitate hydrogen-atom transfer in the ROS generation cycle.
279 DE approximately 100 kcal.mol(-1)) through a hydrogen-atom transfer mechanism, and the transformation
280 wed by 1) PMe3 attack on the nitride, 2) net hydrogen-atom transfer to form N-H bonds, or 3) C-H amin
281 uoromethane substrate (n = 1) undergoes both hydrogen-atom transfer, forming the copper hydroxide com
288 ers both a rationale for the relatively high hydrogen-atom-transfer reactivity of [Mn(IV)(O)(N4py)](2
289 are harmonized with a thermodynamic model of hydrogen-atom-transfer reactivity, which predicts a corr
291 netic coupling of the Co-C bond cleavage and hydrogen-atom-transfer steps at ambient temperatures has
293 s is the first spectroscopic confirmation of hydrogen atom tunneling governing 1,2-H-shift reactions
295 cays to the lower-energy trans conformer via hydrogen-atom tunneling through the torsional barrier, w
296 he Bond Dissociation Energies (BDEs) of each hydrogen atom type in the CB series, providing an explan
297 bonds are modeled in the absence of explicit hydrogen atoms, via a three-body term that favors tetrah
298 (resolution </= 1.8 A) and the positions of hydrogen atoms were generated using a computational meth
299 Alkyl Grignard reagents that contain beta-hydrogen atoms were used in a stereospecific nickel-cata
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