The catalytic role of N-heterocyclic carbene in a metal-free conversion of carbon dioxide into methanol: a computational mechanism study.
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Computational approaches to the chemical conversion of carbon dioxide.Recent advances in carbon dioxide capture, fixation, and activation by using N-heterocyclic carbenes.Towards a methanol economy based on homogeneous catalysis: methanol to H2 and CO2 to methanol.Imidazolium Ionic Liquids, Imidazolylidene Heterocyclic Carbenes, and Zeolitic Imidazolate Frameworks for CO2 Capture and Photochemical Reduction.A kinetic study on the reduction of CO2 by frustrated Lewis pairs: from understanding to rational design.A DFT kinetic study on 1,3-dipolar cycloaddition reactions in solution.A case study of the mechanism of alcohol-mediated Morita Baylis-Hillman reactions. The importance of experimental observationsOn the role of CO2 in NHC-catalyzed oxidation of aldehydesN-heterocyclic carbene organocatalysts for dehydrogenative coupling of silanes and hydroxyl compounds.Intramolecular B/N frustrated Lewis pairs and the hydrogenation of carbon dioxide.Phosphine catalyzed reduction of CO2 with boranes.Catalyst-free N-methylation of amines using CO2.Zwitterionic indenylammonium with carbon-centred reactivity towards reversible CO2 binding and catalytic reduction.Ionic liquid-based green processes for energy production.A computational experiment to study hydrogenations of various unsaturated compounds catalyzed by a rationally designed metal-free catalyst.Expanding the Ligand Framework Diversity of Carbodicarbenes and Direct Detection of Boron Activation in the Methylation of Amines with CO2.A comparative computational study of N-heterocyclic olefin and N-heterocyclic carbene mediated carboxylative cyclization of propargyl alcohols with CO2.Theoretical estimation of kinetic parameters for nucleophilic substitution reactions in solution: an application of a solution translational entropy model.Formylation or methylation: what determines the chemoselectivity of the reaction of amine, CO2, and hydrosilane catalyzed by 1,3,2-diazaphospholene?Elucidation of the reaction mechanisms and diastereoselectivities of phosphine-catalyzed [4 + 2] annulations between allenoates and ketones or aldimines.Copper-catalyzed C-C bond-forming transformation of CO2 to alcohol oxidation level: selective synthesis of homoallylic alcohols from allenes, CO2, and hydrosilanes.Unveiling the peculiar hydrogen bonding behavior of solvated N-heterocyclic carbenes.A DFT study on the reaction mechanism of dimerization of methyl methacrylate catalyzed by N-heterocyclic carbene.Metal-Free Reduction of CO2 to Methoxyborane under Ambient Conditions through Borondiformate Formation.Facile Access to Transition-Metal-Carbonyl Complexes with an Amidinate-Stabilized Chlorosilylene LigandA début for base stabilized monoalkylsilylenesSyntheses of Iron Carbonyl N-Heterocyclic Stannylene ComplexesAb initio study on anomalous structures of anionic [(N-heterocycle)-CO2]− complexes
P2860
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P2860
The catalytic role of N-heterocyclic carbene in a metal-free conversion of carbon dioxide into methanol: a computational mechanism study.
description
2010 nî lūn-bûn
@nan
2010 թուականի Սեպտեմբերին հրատարակուած գիտական յօդուած
@hyw
2010 թվականի սեպտեմբերին հրատարակված գիտական հոդված
@hy
2010年の論文
@ja
2010年論文
@yue
2010年論文
@zh-hant
2010年論文
@zh-hk
2010年論文
@zh-mo
2010年論文
@zh-tw
2010年论文
@wuu
name
The catalytic role of N-hetero ...... computational mechanism study.
@ast
The catalytic role of N-hetero ...... computational mechanism study.
@en
The catalytic role of N-hetero ...... computational mechanism study.
@nl
type
label
The catalytic role of N-hetero ...... computational mechanism study.
@ast
The catalytic role of N-hetero ...... computational mechanism study.
@en
The catalytic role of N-hetero ...... computational mechanism study.
@nl
prefLabel
The catalytic role of N-hetero ...... computational mechanism study.
@ast
The catalytic role of N-hetero ...... computational mechanism study.
@en
The catalytic role of N-hetero ...... computational mechanism study.
@nl
P2093
P356
P1476
The catalytic role of N-hetero ...... computational mechanism study.
@en
P2093
Fang Huang
Zhi-Xiang Wang
P304
12388-12396
P356
10.1021/JA103531Z
P407
P577
2010-09-01T00:00:00Z