SCOPUS 정보 검색 플랫폼

Volumn 8, Issue 4, 2002, Pages 95-101

A QSPR-approach to the estimation of the pKHB of six-membered nitrogen-heterocycles using quantum mechanically derived descriptors

(2) Hennemann, Matthias a Clark, Timothy a

a UNIVERSITY OF ERLANGEN NUREMBERG (Germany)

Author keywords

AM1; Hydrogen bonding; pKHB; QSPR

Indexed keywords

CHEMICAL COMPOUND; FUSED HETEROCYCLIC RINGS; HETEROCYCLIC NITRO COMPOUND; NITROGEN;

ARTICLE; CONTROLLED STUDY; ELECTRIC POTENTIAL; ENERGY; EXPERIMENTAL DESIGN; HYDROGEN BOND; MATHEMATICAL COMPUTING; MOLECULAR MODEL; PRIORITY JOURNAL; QUANTITATIVE STRUCTURE PROPERTY RELATION; QUANTUM MECHANICS; THERMODYNAMICS;

HETEROCYCLIC COMPOUNDS, 1-RING; KINETICS; MODELS, MOLECULAR; MOLECULAR STRUCTURE; NITROGEN; QUANTUM THEORY;

EID: 0036972931 PISSN: 16102940 EISSN: None Source Type: Journal
DOI: 10.1007/s00894-002-0075-z Document Type: Article

Times cited : (22)

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