The arrangement of first- and second-sphere water molecules in divalent magnesium complexes: Results from molecular orbital and density functional theory and from structural crystallography

Journal of Physical Chemistry B

Volumn 106, Issue 19, 2002, Pages 5118-5134

  Markham, George D ^a   Glusker, Jenny P ^a   Bock, Charles W ^a,b  

^a FOX CHASE CANCER CENTER   (United States)

^b THOMAS JEFFERSON UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

MOLECULAR ORBITAL;

COMPLEXATION; CRYSTAL STRUCTURE; CRYSTALLOGRAPHY; ENTHALPY; HYDRATES; HYDROGEN BONDS; MAGNESIUM PRINTING PLATES; MOLECULAR ORIENTATION; NEUTRON DIFFRACTION; PROBABILITY DENSITY FUNCTION; WATER;

MOLECULAR STRUCTURE;

EID: 0037118418     PISSN: 10895647     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp020078x     Document Type: Article

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