Department of Chemistry, Isfahan University of Technology, Isfahan, I.R. IRAN
10.30492/ijcce.1988.12274
Abstract
Body's iterative force-field computer program has been used to calculate strain energies in cyclooctanone (I). 348 MHZ 1H NMR spectra of (I) have been investigated over the temperature range of 25° to -160°C. Two conformation processes affect the 1H NMR spectrum of (I). Iterative force-field calculations on the conformations and conformational interconversion paths of (I) give results consistent with the NMR findings.
Ghiaci, M. (1988). Iterative Force-Field Calculation and Molecular Dynamics of Cyclooctanone. Iranian Journal of Chemistry and Chemical Engineering, 7(1), 33-46. doi: 10.30492/ijcce.1988.12274
MLA
Mehran Ghiaci. "Iterative Force-Field Calculation and Molecular Dynamics of Cyclooctanone". Iranian Journal of Chemistry and Chemical Engineering, 7, 1, 1988, 33-46. doi: 10.30492/ijcce.1988.12274
HARVARD
Ghiaci, M. (1988). 'Iterative Force-Field Calculation and Molecular Dynamics of Cyclooctanone', Iranian Journal of Chemistry and Chemical Engineering, 7(1), pp. 33-46. doi: 10.30492/ijcce.1988.12274
VANCOUVER
Ghiaci, M. Iterative Force-Field Calculation and Molecular Dynamics of Cyclooctanone. Iranian Journal of Chemistry and Chemical Engineering, 1988; 7(1): 33-46. doi: 10.30492/ijcce.1988.12274