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Enhanced long-range Si...N interactions in organosilicon cations. A theoretical study
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SYSNO ASEP 0194122 Document Type J - Journal Article R&D Document Type Journal Article Subsidiary J Ostatní články Title Enhanced long-range Si...N interactions in organosilicon cations. A theoretical study Author(s) Havlas, Zdeněk (UOCHB-X) RID, ORCID
Bock, H. (DE)Source Title Collection of Czechoslovak Chemical Communications. - : Ústav organické chemie a biochemie AV ČR, v. v. i. - ISSN 0010-0765
Roč. 66, č. 3 (2001), s. 473-482Number of pages 10 s. Language eng - English Country CZ - Czech Republic Keywords amines ; silanes Subject RIV CC - Organic Chemistry R&D Projects LN00A032 GA MŠMT - Ministry of Education, Youth and Sports (MEYS) CEZ AV0Z4055905 - UOCHB-X Annotation For the model organosilicon cation H3N...SiH3, potential curves been calculated by density functional theory at hte B3LYP level, by both MP2 and MP4 perturbation procedures and by a Coupled Cluster approach. Workplace Institute of Organic Chemistry and Biochemistry Contact asep@uochb.cas.cz ; Kateřina Šperková, Tel.: 232 002 584 ; Jana Procházková, Tel.: 220 183 418 Year of Publishing 2002
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