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Journal of Molecular Structure: THEOCHEM

Volumn 587, Issue 1-3, 2002, Pages 129-146

Density functional study of the di-protonated allopurinol2+ tautomers

(2) Costas, María Eugenia a Acevedo Chávez, Rodolfo a

a UNIVERSIDAD NACIONAL AUTÓNOMA DE MÉXICO (Mexico)

Author keywords

Allopurinol; DFT calculations; Purine isomer; Tautomerism

Indexed keywords

ALLOPURINOL; PURINE DERIVATIVE;

ARTICLE; CALCULATION; DENSITY FUNCTIONAL STUDY; ENERGY; GEOMETRY; INFRARED RADIATION; ISOMER; OXIDATION REDUCTION REACTION; PROTON TRANSPORT; THEORY; THERMODYNAMICS;

EID: 0037025233 PISSN: 01661280 EISSN: None Source Type: Journal
DOI: 10.1016/S0166-1280(02)00106-9 Document Type: Article

Times cited : (4)

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* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.