Bonding of seven carbonyl groups to a single metal atom: Theoretical study of M(CO)n (M = Ti, Zr, Hf; n = 7, 6, 5, 4)

Journal of the American Chemical Society

Volumn 130, Issue 24, 2008, Pages 7756-7765

  Luo, Qiong ^a,b,c   Li, Qian Shu ^a,d   Zhong, Heng Yu ^c   Xie, Yaoming ^e   King, R Bruce ^a,e   Schaefer III, Henry F ^e  

^a SOUTH CHINA NORMAL UNIVERSITY   (China)

^b CENTRAL SOUTH UNIVERSITY   (China)

^c INSTITUTE OF CHEMISTRY   (China)

^d BEIJING INSTITUTE OF TECHNOLOGY   (China)

^e UNIVERSITY OF GEORGIA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CHEMICAL MODIFICATION; COBALT ALLOYS; COBALT COMPOUNDS; THERMOCHEMISTRY;

CARBONYL GROUPS; EQUILIBRIUM GEOMETRIES; GROUP 4; HOMOLEPTIC; METAL ATOMS; VIBRATIONAL FREQUENCIES;

CARBONYLATION;

CARBONYL DERIVATIVE; METAL;

ARTICLE; CHEMICAL BOND; CHEMICAL STRUCTURE; DENSITY FUNCTIONAL THEORY; ELECTRON; ENERGY; GEOMETRY; THEORETICAL STUDY; VIBRATION;

EID: 45249100844     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja8003655     Document Type: Article

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