SCOPUS 정보 검색 플랫폼

Volumn 17, Issue 11, 2011, Pages 2847-2862

Hydrogen bonds determine the structures of the ternary heterocyclic complexes C 2H 4O•••2HF, C 2H 5N•••2HF and C 2H 4S•••2HF: Density functional theory and topological calculations

(4) Oliveira, Boaz G a Araújo, Regiane C M U a Carvalho, Antônio B a Ramos, Mozart N b

a FEDERAL UNIVERSITY OF PARAÍBA (Brazil)

b FEDERAL UNIVERSITY OF PERNAMBUCO (Brazil)

Author keywords

B3LYP; Heterocyclic; Hydrogen bonds; QTAIM

Indexed keywords

HYDROFLUORIC ACID; PROTON;

ARTICLE; CHEMICAL BOND; CHEMICAL STRUCTURE; DENSITY FUNCTIONAL THEORY; DIPOLE; HYDROGEN BOND; PRIORITY JOURNAL; QUANTUM THEORY; SPECTROSCOPY; VIBRATION;

CARBOHYDRATE CONFORMATION; HETEROCYCLIC COMPOUNDS; HYDROGEN BONDING; MODELS, MOLECULAR; QUANTUM THEORY; REPRODUCIBILITY OF RESULTS;

EID: 80255138715 PISSN: 16102940 EISSN: 09485023 Source Type: Journal
DOI: 10.1007/s00894-011-0969-8 Document Type: Article

Times cited : (24)

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