Ab initio prediction of ring strain enthalpies of cyclic amine-boranes

Tetrahedron Letters

Volumn 39, Issue 50, 1998, Pages 9147-9150

  Gilbert, Thomas M ^a  

^a NORTHERN ILLINOIS UNIVERSITY   (United States)

Author keywords

Boron heterocycles; Computer assisted methods; Nitrogen heterocycles; Steric and strain effects

Indexed keywords

1 AZONIA 2 BORATACYCLOALKANE; AMINE; BORANE DERIVATIVE; CYCLOALKANE; UNCLASSIFIED DRUG;

ARTICLE; CALCULATION; CHEMICAL BOND; CYCLIZATION; ENTHALPY; ISOLATION PROCEDURE; MOLECULAR INTERACTION; PREDICTION; STOICHIOMETRY; STRUCTURE ACTIVITY RELATION; STRUCTURE ANALYSIS;

EID: 0032506625     PISSN: 00404039     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0040-4039(98)02105-4     Document Type: Article

References (5)

1. [1] Streitwieser A., Heathcock, CH. Introduction to Organic Chemistry, 3rd Edn. New York: MacMillan, 1985: 81-87.
2. [2] Beeker K. Amine-dihydroboranes containing an annular N-B donor bond. In: Gmelin Handbuch der Anorganischen Chemie, Borverbindungen 15, V. 46, New Supplement Series. New York: Springer-Verlag, 1977: Section 1.4.2.
3. [3] Frisch MJ, Trucks GW, Schlegel HS, Gill PMW, Johnson BG, Robb MA, Cheeseman JR, Keith TA, Petersson GA, Montgomery JA, Raghavachari K, Al-Laham MA, Zakrzewski VG, Ortiz JV, Foresman JB, Cioslowski J, Stefanov BB, Nanayakkara A, Challacombe M, Peng CY, Ayala PY, Chen W, Wong MW, Andres JL, Replogle ES, Gomberts R, Martin RL, Fox DJ, Binkley JS, Defrees DJ, Baker I, Stewart JJP, Head-Gordon M, Gonzalez C, Pople JA. Gaussian 94, Revision B2 Gaussian, Inc: Pittsburgh, PA, 1995.
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5. [5] Haaland A. Angew. Chem. Int. Ed. Eng. 1989; 28: 992-1007 and references therein.