Theoretical understanding of ruthenium(II) based fluoride sensor derived from 4,5-bis(benzimidazol-2-yl)imidazole (H 3ImBzim) and bipyridine: Electronic structure and binding nature

Journal of Physical Chemistry A

Volumn 115, Issue 10, 2011, Pages 1985-1991

  Wang, Jian ^a   Bai, Fu Quan ^a   Xia, Bao Hui ^a   Sun, Lei ^a   Zhang, Hong Xing ^a  

^a JILIN UNIVERSITY   (China)

Author keywords

[No Author keywords available]

Indexed keywords

ABSORPTION BAND; ACETONITRILE SOLUTIONS; ANION SENSORS; BASIS SETS; BENCHMARK TESTS; BIPYRIDINES; DETECTION MECHANISM; DETECTION PROCESS; EXPERIMENTAL MEASUREMENTS; EXPERIMENTAL OBSERVATION; METAL TO LIGAND CHARGE TRANSFERS; MOLECULAR DETECTORS; SINGLET EXCITED STATE;

ABSORPTION; ABSORPTION SPECTROSCOPY; ACETONITRILE; CHARGE TRANSFER; ELECTRIC EXCITATION; ELECTRONIC PROPERTIES; ELECTRONIC STRUCTURE; NEGATIVE IONS; RUTHENIUM; SENSORS;

DENSITY FUNCTIONAL THEORY;

2,2' BIPYRIDINE; 4,5 BIS(BENZIMIDAZOL 2 YL)IMIDAZOLE; 4,5-BIS(BENZIMIDAZOL-2-YL)IMIDAZOLE; BENZIMIDAZOLE DERIVATIVE; FLUORIDE; PROTON; RUTHENIUM;

ARTICLE; CHEMICAL ANALYSIS; CHEMICAL STRUCTURE; CHEMISTRY; COLORIMETRY; CONFORMATION; ELECTRON; HYDROGEN BOND; INSTRUMENTATION; QUANTUM THEORY; ULTRAVIOLET SPECTROPHOTOMETRY;

2,2'-DIPYRIDYL; BENZIMIDAZOLES; CHEMISTRY TECHNIQUES, ANALYTICAL; COLORIMETRY; ELECTRONS; FLUORIDES; HYDROGEN BONDING; MODELS, MOLECULAR; MOLECULAR CONFORMATION; PROTONS; QUANTUM THEORY; RUTHENIUM; SPECTROPHOTOMETRY, ULTRAVIOLET;

EID: 79952610509     PISSN: 10895639     EISSN: 15205215     Source Type: Journal    
DOI: 10.1021/jp1088383     Document Type: Article

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