Noncovalent interactions in a transition-metal triphenylphosphine complex: A density functional case study

Inorganic Chemistry

Volumn 48, Issue 11, 2009, Pages 4622-4624

  Sieffert, Nicolas ^a   Bühl, Michael ^a  

^a UNIVERSITY OF ST ANDREWS   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

LIGAND; ORGANOMETALLIC COMPOUND; ORGANOPHOSPHORUS COMPOUND; RUTHENIUM; TRIPHENYLPHOSPHINE;

ARTICLE; CHEMICAL MODEL; CHEMISTRY; COMPUTER SIMULATION; CONFORMATION; SYNTHESIS; THERMODYNAMICS;

COMPUTER SIMULATION; LIGANDS; MODELS, CHEMICAL; MOLECULAR CONFORMATION; ORGANOMETALLIC COMPOUNDS; ORGANOPHOSPHORUS COMPOUNDS; RUTHENIUM; THERMODYNAMICS;

EID: 66249122361     PISSN: 00201669     EISSN: None     Source Type: Journal    
DOI: 10.1021/ic900347e     Document Type: Article

References (25)

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23. 3 as model ligands, the corresponding BSSEs are also significantly smaller (2.1 and 3.6 kcal/mol, respectively; see Table 3).
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25. -1 at T = 203.15 K and P = 1354 atm).