Quantum-mechanical evaluation of π-π Versus substituent-π interactions in π stacking: Direct evidence for the Wheeler-Houk picture

Journal of the American Chemical Society

Volumn 136, Issue 50, 2014, Pages 17386-17389

  Parrish, Robert M ^a   Sherrill, C David ^a  

^a GEORGIA INSTITUTE OF TECHNOLOGY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

FUNCTIONAL GROUPS; GROUP THEORY; PERTURBATION TECHNIQUES;

DIRECT INTERACTIONS; GROUP PARTITIONS; INTERACTION ENERGIES; LOCAL EFFECTS; NON-LOCAL EFFECT; QUANTUM MECHANICAL; SIGMA BONDS; SYMMETRY ADAPTED PERTURBATION THEORY;

QUANTUM THEORY;

BENZENE; DIMER; FUNCTIONAL GROUP; HYDROGEN;

ARTICLE; DENSITY; DISPERSION; ELECTRON; ENERGY; PROTEIN INTERACTION; QUANTUM MECHANICS; STATIC ELECTRICITY; CHEMICAL STRUCTURE; QUANTUM THEORY;

MODELS, MOLECULAR; QUANTUM THEORY;

EID: 84919340256     PISSN: 00027863     EISSN: 15205126     Source Type: Journal    
DOI: 10.1021/ja5101245     Document Type: Article

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