An ab initio study on the concerted interaction between chalcogen and pnicogen bonds

Journal of Molecular Modeling

Volumn 20, Issue 12, 2014, Pages

  Asiabar, Bahman Mohammadian ^a   Esrafili, Mehdi D ^b   Mohammadian Sabet, Fariba ^b   Sobhi, Hamid Reza ^c   Javaheri, Majid ^d  

^a Imam Ali Military University   (Iran)

^b UNIVERSITY OF MARAGHEH   (Iran)

^c PAYAME NOOR UNIVERSITY   (Iran)

^d UNIVERSITY OF TEHRAN   (Iran)

Author keywords

Chalcogen bond; Cooperativity; IR stretching frequency; Pnicogen bond; Spin spin coupling constants

Indexed keywords

CHALCOGEN; HALOGEN; PNICOGEN; UNCLASSIFIED DRUG; CHALCONE DERIVATIVE; NITROGEN; PHOSPHORUS;

AB INITIO CALCULATION; ARTICLE; CHALCOGEN BOND; CHEMICAL BOND; CONSTANTS AND COEFFICIENTS; CONTROLLED STUDY; ELECTRON SPIN RESONANCE; MATHEMATICAL ANALYSIS; MOLECULAR RECOGNITION; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; PNICOGEN BOND; REACTION ANALYSIS; SPIN SPIN COUPLING CONSTANT; STATIC ELECTRICITY; ANISOTROPY; CHEMICAL STRUCTURE; CHEMISTRY; ENERGY TRANSFER; MOLECULAR DOCKING;

ANISOTROPY; CHALCONES; ENERGY TRANSFER; MAGNETIC RESONANCE SPECTROSCOPY; MOLECULAR DOCKING SIMULATION; MOLECULAR STRUCTURE; NITROGEN; PHOSPHORUS; STATIC ELECTRICITY;

EID: 84919928385     PISSN: 16102940     EISSN: 09485023     Source Type: Journal    
DOI: 10.1007/s00894-014-2545-5     Document Type: Article

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