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Volumn 112, Issue 30, 2008, Pages 6902-6907

Reactions of actinide metal atoms with ethane: Computation and observation of new Th and U ethylidene dihydride, metallacyclopropane dihydride, and vinyl metal trihydride complexes

Author keywords

[No Author keywords available]

Indexed keywords

ACTINIDE; AGOSTIC INTERACTIONS; DIHYDRIDE; EXPERIMENTAL INVESTIGATIONS; FUNCTIONAL THEORY; GROUP 4; ISOTOPIC SUBSTITUTIONS; METAL ATOMS; METAL HYDRIDE; METALLACYCLOPROPANE; METHANE REACTION; ORGANOMETALLIC COMPLEXES; SOLID ARGON; TRIHYDRIDE COMPLEXES; URANIUM ATOMS; VIBRATIONAL FREQUENCIES;

EID: 49549112929     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp801692s     Document Type: Article
Times cited : (34)

References (34)
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    • 2 complexes).
    • 2 complexes).
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    • 4, The two Th-H bond lengths given in Figure 1 must be reversed
    • 4). The two Th-H bond lengths given in Figure 1 must be reversed.
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    • Andrews, L.1    Cho, H.-G.2
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    • and references therein
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    • Andrews, L.1    Citra, A.2
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    • and references therein
    • Andrews, L. Chem. Soc. Rev. 2004, 33, 123 and references therein.
    • (2004) Chem. Soc. Rev , vol.33 , pp. 123
    • Andrews, L.1
  • 23
    • 49549122796 scopus 로고    scopus 로고
    • Kudin, K. N., et al. Gaussian 03, Revision B.04, Gaussian, Inc., Pittsburgh, PA, 2003.
    • Kudin, K. N., et al. Gaussian 03, Revision B.04, Gaussian, Inc., Pittsburgh, PA, 2003.
  • 29
    • 0031077178 scopus 로고    scopus 로고
    • 2 in argon).
    • 2 in argon).
  • 31
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    • 2 in argon).
    • 2 in argon).
  • 33
    • 49549113286 scopus 로고    scopus 로고
    • A like computation for the n-propylidene complex gave essentially the same structure about carbon as found for the ethylidene complex, so the second methyl group has no significant effect. Furthermore, isobutylidene and neopentylidene complex counterparts also have the same computed agostic parameters so extra methyl groups on the ß carbon have no effect on the agostic distortion
    • A like computation for the n-propylidene complex gave essentially the same structure about carbon as found for the ethylidene complex, so the second methyl group has no significant effect. Furthermore, isobutylidene and neopentylidene complex counterparts also have the same computed agostic parameters so extra methyl groups on the ß carbon have no effect on the agostic distortion.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.