Determination of the absolute configuration of a chiral oxadiazol-3-one calcium channel blocker, resolved using chiral chromatography, via concerted density functional theory calculations of its vibrational circular dichroism, electronic circular dichroism, and optical rotation

Journal of Organic Chemistry

Volumn 72, Issue 13, 2007, Pages 4707-4715

  Stephens, P J ^a   Devlin, F J ^a   Gasparrini, F ^b   Ciogli, A ^b   Spinelli, D ^c   Cosimelli, B ^d  

^a UNIVERSITY OF SOUTHERN CALIFORNIA   (United States)

^b SAPIENZA UNIVERSITY OF ROME   (Italy)

^c UNIVERSITY OF BOLOGNA   (Italy)

^d UNIVERSITY OF NAPLES FEDERICO II   (Italy)

Author keywords

[No Author keywords available]

Indexed keywords

CHANNEL BLOCKERS; CHIRAL CHROMATOGRAPHY; CHIROPTICAL PROPERTIES;

CALCIUM; CHIRALITY; CHROMATOGRAPHIC ANALYSIS; DENSITY FUNCTIONAL THEORY; DICHROISM; ENANTIOMERS; ENANTIOSELECTIVITY; OPTICAL ROTATION;

ORGANIC COMPOUNDS;

CALCIUM CHANNEL BLOCKING AGENT; DILTIAZEM; OXADIAZOL 3 ONE CALCIUM CHANNEL BLOCKER; UNCLASSIFIED DRUG;

ARTICLE; CHIRAL CHROMATOGRAPHY; CIRCULAR DICHROISM; DRUG STRUCTURE; ENANTIOSELECTIVITY;

CALCIUM CHANNEL BLOCKERS; CHROMATOGRAPHY; CIRCULAR DICHROISM; ELECTRONS; MODELS, MOLECULAR; MOLECULAR CONFORMATION; OPTICAL ROTATION; OXADIAZOLES; SPECTROPHOTOMETRY, INFRARED; STEREOISOMERISM; VIBRATION;

EID: 34250797932     PISSN: 00223263     EISSN: None     Source Type: Journal    
DOI: 10.1021/jo070302k     Document Type: Article

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