1,3-bis(2,4,6-trimethylphenyl)-4,5-dihydro-2h-imidazol-1-ium-2-ide

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CAS: 173035-11-5
MF: C21H28N2
MW: 308.46042
Synonyms: 1,3-bis(2,4,6-trimethylphenyl)-4,5-dihydro-2h-imidazol-1-ium-2-ide

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Liang Deng

Chinese Academy of Sciences
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Song Gao

Peking University
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Jeremiah A. Johnson

Massachusetts Institute of Technology
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Troy Van Voorhis

Massachusetts Institute of Technology
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Graeme Henkelman

The University of Texas at Austin
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Gregory H. Robinson

The University of Georgia
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Co-reporter: Yuzhong Wang, Yaoming Xie, Pingrong Wei, Henry F. Schaefer and Gregory H. Robinson  
pp: 5941-5944
Publication Date(Web):25 Nov 2015
DOI: 10.1039/C5DT03894D
Reaction of the anionic N-heterocyclic dicarbene (NHDC), [:C{[N(2,6-Pri2C6H3)]2CHCLi}]n (1), with SiCl4 gives the trichlorosilyl-substituted (at the C4 carbon) N-heterocyclic carbene complex (7). Abnormal carbene–SiCl4 complex (8) may be conveniently synthesized by combining 7 with HCl·NEt3. In addition, 7 may react with CH2Cl2 in warm hexane, giving the abnormal carbene-complexed SiCl3+ cation (9). The nature of the bonding in 9 was probed with complementary DFT computations.
Co-reporter: Yuzhong Wang, Yaoming Xie, Pingrong Wei, Henry F. Schaefer and Gregory H. Robinson
pp: NaN5944-5944
Publication Date(Web):2015/11/25
DOI: 10.1039/C5DT03894D
Reaction of the anionic N-heterocyclic dicarbene (NHDC), [:C{[N(2,6-Pri2C6H3)]2CHCLi}]n (1), with SiCl4 gives the trichlorosilyl-substituted (at the C4 carbon) N-heterocyclic carbene complex (7). Abnormal carbene–SiCl4 complex (8) may be conveniently synthesized by combining 7 with HCl·NEt3. In addition, 7 may react with CH2Cl2 in warm hexane, giving the abnormal carbene-complexed SiCl3+ cation (9). The nature of the bonding in 9 was probed with complementary DFT computations.

Henry F. Schaefer

University of Georgia
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Marcetta Y. Darensbourg

Texas A&M University
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Hairong Guan

University of Cincinnati
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Bernd Plietker

Universit?t Stuttgart
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