An ab initio study of the absorption spectra of indirubin, isoindigo, and related derivatives

Journal of Physical Chemistry A

Volumn 110, Issue 17, 2006, Pages 5629-5635

  Perpète, Eric A ^a,b   Preat, Julien ^a   André, Jean Marie ^a   Jacquemin, Denis ^a,b  

^a UNIVERSITY OF NAMUR   (Belgium)

^b FUND FOR SCIENTIFIC RESEARCH   (Belgium)

Author keywords

[No Author keywords available]

Indexed keywords

EXCITATION PROCESSES; POLARIZABLE CONTINUUM MODEL; UNDERESTIMATED EXCITATION ENERGIES;

DERIVATIVES; HYDROGEN BONDS; LIGHT ABSORPTION; MOLECULAR DYNAMICS; PROBABILITY DENSITY FUNCTION; SULFUR;

DYES;

INDIRUBIN; INDOLE DERIVATIVE; ISOINDIGOTIN;

ARTICLE; CHEMICAL MODEL; CHEMICAL STRUCTURE; CHEMISTRY; COMPUTER SIMULATION; METHODOLOGY; QUANTUM THEORY; SENSITIVITY AND SPECIFICITY; ULTRAVIOLET SPECTROPHOTOMETRY;

COMPUTER SIMULATION; INDOLES; MODELS, CHEMICAL; MODELS, MOLECULAR; MOLECULAR STRUCTURE; QUANTUM THEORY; SENSITIVITY AND SPECIFICITY; SPECTROPHOTOMETRY, ULTRAVIOLET;

EID: 33744484553     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp060069e     Document Type: Article

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