DFT calculations of d0M(NR)(CHtBu)(X)(Y) (M = Mo, W; R = CPh3, 2,6-iPr–C6H3; X and Y = CH2tBu, OtBu, OSi(OtBu)3) olefin metathesis catalysts: structural, spectroscopic and electronic properties
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Direct observation of reaction intermediates for a well defined heterogeneous alkene metathesis catalyst.Synthesis of High Oxidation State Molybdenum Imido Heteroatom-Substituted Alkylidene ComplexesRecent advances in high oxidation state Mo and W imido alkylidene chemistry.Hypercoordinate β-carbon in Grubbs and Schrock olefin metathesis metallacycles.DFT study on the reaction mechanism of the ring closing enyne metathesis (RCEYM) catalyzed by molybdenum alkylidene complexes.In Silico Olefin Metathesis with Ru-Based Catalysts Containing N-Heterocyclic Carbenes Bearing C60 Fullerenes.Structure, energy, vibrational spectrum, and Bader's analysis of π···H hydrogen bonds and H(-δ)···H(+δ) dihydrogen bonds.Diazomethane umpolung atop anthracene: an electrophilic methylene transfer reagent.
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Q30397757-C9CA045C-6715-44A2-A290-E19CB46ED16FQ37202254-A8B4E920-A6A1-4545-9F78-BCA5EE5F56FDQ37305257-4455E4A8-74DF-40D5-B025-5143A46666A1Q40514681-7DD3148B-459D-4598-B34D-94DF0DA58A44Q46936981-9634A487-326F-4388-9DD2-FBD4E5861E5CQ49169360-9F331886-76DC-455E-9772-49B46AC045A8Q50239533-76B73F43-67C6-4885-94E1-4184FC0FEF7FQ52314825-348F6023-378A-4A53-AF1B-5AE9AB961A37
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DFT calculations of d0M(NR)(CHtBu)(X)(Y) (M = Mo, W; R = CPh3, 2,6-iPr–C6H3; X and Y = CH2tBu, OtBu, OSi(OtBu)3) olefin metathesis catalysts: structural, spectroscopic and electronic properties
description
im Januar 2006 veröffentlichter wissenschaftlicher Artikel
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scientific article published on 30 May 2006
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wetenschappelijk artikel
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наукова стаття, опублікована у 2006
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name
DFT calculations of d0M(NR)(CH ...... opic and electronic properties
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DFT calculations of d0M(NR)(CH ...... opic and electronic properties
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type
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DFT calculations of d0M(NR)(CH ...... opic and electronic properties
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DFT calculations of d0M(NR)(CH ...... opic and electronic properties
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prefLabel
DFT calculations of d0M(NR)(CH ...... opic and electronic properties
@en
DFT calculations of d0M(NR)(CH ...... opic and electronic properties
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P50
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DFT calculations of d0 M(NR)(C ...... opic and electronic properties
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Christophe Copéret
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10.1039/B604481F
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2006-05-30T00:00:00Z