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Journal of the American Chemical Society

Volumn 123, Issue 46, 2001, Pages 11431-11440

UV - Visible absorption spectra of [Ru(E)(E′)(CO)2(iPr-DAB)] (E = E′ = SnPh3 or Cl; E = SnPh3 or Cl, E′ = CH3; iPr-DAB = N, N′-di-isopropyl-1,4-diaza-1,3-butadiene): Combination of CASSCF/CASPT2 and TD-DFT calculations

(6) Turki, M a Daniel, C a Zalis S b Vlček, Jr b,c Van Slageren, J d Stufkens, D J d

a UNIVERSITÉ DE STRASBOURG (France)

b J HEYROVSKÝ INSTITUTE OF PHYSICAL CHEMISTRY (Czech Republic)

c QUEEN MARY UNIVERSITY OF LONDON (United Kingdom)

d UNIVERSITY OF AMSTERDAM (Netherlands)

Author keywords

[No Author keywords available]

Indexed keywords

ELECTRON DENSITY REDISTRIBUTION; METAL-TO-LIGAND CHARGE TRANSFER (MLCT);

CARRIER CONCENTRATION; CHEMICAL BONDS; CHLORINE COMPOUNDS; HALOGEN COMPOUNDS; MOLECULES; RUTHENIUM; TIN;

ULTRAVIOLET SPECTROSCOPY;

RUTHENIUM DERIVATIVE; TIN;

ARTICLE; CALCULATION; CHEMICAL BOND; CHEMICAL STRUCTURE; ION TRANSPORT; MOLECULAR MODEL; OSCILLATION; ULTRAVIOLET SPECTROSCOPY;

EID: 0035929975 PISSN: 00027863 EISSN: None Source Type: Journal
DOI: 10.1021/ja010782b Document Type: Article

Times cited : (98)

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