Experimental and ab initio calculational studies on 2,3-diketo- benzopiperazine

Journal of Molecular Structure

Volumn 705, Issue 1-3, 2004, Pages 133-139

  Jian, Fang Fang ^a   Zhao, Pu Su ^a  

^a QINGDAO UNIVERSITY OF SCIENCE AND TECHNOLOGY   (China)

Author keywords

Ab initio calculation; Crystal structure; Second order optical non linearity; Synthesis; Vibrational frequencies

Indexed keywords

2,3 DIKETOBENZOPIPERAZINE; PIPERAZINE DERIVATIVE; UNCLASSIFIED DRUG;

AB INITIO CALCULATION; ARTICLE; CHEMICAL ANALYSIS; DENSITY FUNCTIONAL THEORY; HYPERPOLARIZATION; INFRARED SPECTROSCOPY; SYNTHESIS; THERMODYNAMICS; VIBRATION; X RAY DIFFRACTION;

EID: 4444244043     PISSN: 00222860     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.molstruc.2004.06.027     Document Type: Article

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