Structures, energies, and spin-spin coupling constants of methyl-substituted 1,3-diborata-2,4-diphosphoniocyclobutanes: Four-member B-P-B-P rings B 2P 2(CH 3) nH 8- n, with n = 0, 1, 2, 4

Journal of Physical Chemistry A

Volumn 115, Issue 38, 2011, Pages 10502-10510

  Del Bene, Janet E ^a   Alkorta, Ibon ^b   Elguero, José ^b  

^a YOUNGSTOWN STATE UNIVERSITY   (United States)

^b INSTITUTO DE QUÍMICA MÉDICA   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO STUDY; AXIAL BONDS; AXIAL POSITIONS; B ATOMS; COUPLING CONSTANTS; ELECTRONIC EFFECTS; EQUATORIAL POSITIONS; EQUILIBRIUM STRUCTURES; EXPERIMENTAL DATA; INTERCONVERSIONS; METHYL GROUP; RELATIVE STABILITIES; SPIN-SPIN COUPLING CONSTANTS; STRUCTURAL INFORMATION; TRANSITION STRUCTURES;

EQUILIBRIUM CONSTANTS; FUNCTIONAL GROUPS; PHOSPHORUS;

ISOMERS;

1,3 DIBORATA 2,4 DIPHOSPHONIOCYCLOBUTANE; 1,3-DIBORATA-2,4-DIPHOSPHONIOCYCLOBUTANE; BORIC ACID; CYCLOBUTANE DERIVATIVE;

ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; CONFORMATION; QUANTUM THEORY;

BORATES; CYCLOBUTANES; MODELS, MOLECULAR; MOLECULAR CONFORMATION; MOLECULAR STRUCTURE; QUANTUM THEORY;

EID: 80053123527     PISSN: 10895639     EISSN: 15205215     Source Type: Journal    
DOI: 10.1021/jp206801x     Document Type: Article

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