Chelate Complex Ni(S2C2H2)2 as a Molecular Model of the Hydrodesulfurization Active Center Full article
| Journal |
Reaction Kinetics and Catalysis Letters
ISSN: 0133-1736 , E-ISSN: 1588-2837 |
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| Output data | Year: 1997, Volume: 61, Number: 1, Pages: 117-122 Pages count : 6 DOI: 10.1007/BF02477522 | ||
| Tags | Ab initio calculations, Hydrodesulfurization, Ni chelate complex | ||
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Abstract:
Electronic states of Ni atom in a square-planar complex Ni(S2C2H2)2 and its molecular adduct with H2S were studied by means ofab initio molecular orbital calculations. H2S adsorption stabilizes the Ni(IV) state (d6) in the complex with the Ni atom shifted from the plane by 0.35 Å.
Cite:
Yudanov I.V.
, Zakharov I.I.
, Startsev A.N.
, Zhidomirov G.M.
Chelate Complex Ni(S2C2H2)2 as a Molecular Model of the Hydrodesulfurization Active Center
Reaction Kinetics and Catalysis Letters. 1997. V.61. N1. P.117-122. DOI: 10.1007/BF02477522 WOS Scopus РИНЦ OpenAlex ANCAN
Chelate Complex Ni(S2C2H2)2 as a Molecular Model of the Hydrodesulfurization Active Center
Reaction Kinetics and Catalysis Letters. 1997. V.61. N1. P.117-122. DOI: 10.1007/BF02477522 WOS Scopus РИНЦ OpenAlex ANCAN
Dates:
| Submitted: | Jul 1, 1996 |
| Accepted: | Aug 15, 1996 |
| Published print: | May 1, 1997 |
Identifiers:
| ≡ Web of science: | WOS:A1997XL65700017 |
| ≡ Scopus: | 2-s2.0-0000258330 |
| ≡ Elibrary: | 13265355 |
| ≡ OpenAlex: | W2333488069 |
| ≡ Chemical Abstracts: | 1997:545756 |
| ≡ Chemical Abstracts (print): | 127:214137 |