DFT computational study of the methanolytic cleavage of DNA and RNA phosphodiester models promoted by the dinuclear Zn(II) complex of 1,3-bis(1,5,9-triazacyclododec-1-yl)propane

Journal of the American Chemical Society

Volumn 135, Issue 45, 2013, Pages 17209-17222

  Maxwell, Christopher I ^a   Mosey, Nicholas J ^b   Stan Brown, R ^b  

^a UPPSALA UNIVERSITY   (Sweden)

^b QUEEN S UNIVERSITY   (Canada)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTATIONAL STUDIES; DENSITY FUNCTIONAL THEORY STUDIES; METHYL PHOSPHATES; PHOSPHODIESTERS; PHOSPHORYL OXYGEN; POSSIBLE MECHANISMS; SOLVENT MOLECULES; TRANSESTERIFICATION PROCESS;

HYDROGEN BONDS; METAL IONS; OXYGEN; PROPANE; RNA;

ZINC;

DNA; LEWIS ACID; METAL ION; ORGANOPHOSPHATE; OXYGEN; RNA; ZINC COMPLEX;

ARTICLE; CATALYSIS; COMPARATIVE STUDY; CONFORMATION; CONTROLLED STUDY; CYCLIZATION; DENSITY FUNCTIONAL THEORY; ENERGY; HYDROGEN BOND; METAL BINDING; METHANOLYSIS; MOLECULE; NUCLEOPHILICITY; PROTON TRANSPORT; TRANSESTERIFICATION; X RAY DIFFRACTION;

COORDINATION COMPLEXES; DNA; MODELS, MOLECULAR; ORGANOPHOSPHATES; PROPANE; RNA; ZINC;

EID: 84887732928     PISSN: 00027863     EISSN: 15205126     Source Type: Journal    
DOI: 10.1021/ja4088264     Document Type: Article

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