Combined experimental and quantum chemical investigation of chiroptical properties of nicotinamide derivatives with and without intramolecular cation-π interactions

Journal of Physical Chemistry A

Volumn 113, Issue 30, 2009, Pages 8754-8764

  Shimizu, Akinori ^a   Mori, Tadashi ^a   Inoue, Yoshihisa ^a   Yamada, Shinji ^b  

^a OSAKA UNIVERSITY   (Japan)

^b OCHANOMIZU UNIVERSITY   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

CD SPECTRA; CHIROPTICAL PROPERTIES; CIRCULAR DICHROISM SPECTRA; DFT METHOD; EXPERIMENTAL ANALYSIS; IDENTICAL CONDITIONS; N-METHYLATION; POLAR SOLVENTS; QUANTUM CHEMICAL INVESTIGATION; S-TRANS; SOLUTION PHASE; SPECIFIC ROTATIONS; STABLE CONFORMERS; STRUCTURAL STUDIES; THEORETICAL SPECTRA; TWO PHASIS; X RAY STRUCTURAL ANALYSIS; X-RAY CRYSTALLOGRAPHIC ANALYSIS; X-RAY CRYSTALLOGRAPHIC STRUCTURES;

AMIDES; DATA STORAGE EQUIPMENT; DERIVATIVES; DICHROISM; POSITIVE IONS; SOLVENTS; STRUCTURAL ANALYSIS; X RAY ANALYSIS;

SPECTRUM ANALYSIS;

CATION; DRUG DERIVATIVE; NICOTINAMIDE;

ARTICLE; CHEMICAL MODEL; CHEMICAL STRUCTURE; CHEMISTRY; CIRCULAR DICHROISM; COMPUTER SIMULATION; QUANTUM THEORY; X RAY CRYSTALLOGRAPHY;

CATIONS; CIRCULAR DICHROISM; COMPUTER SIMULATION; CRYSTALLOGRAPHY, X-RAY; MODELS, CHEMICAL; MODELS, MOLECULAR; NIACINAMIDE; QUANTUM THEORY;

EID: 67651177603     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp904243w     Document Type: Article

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