Vibrational and conformational analysis of 2-methylpentane (cas 107-83-5) and 3-methylpentane

Add time:08/25/2019    Source:sciencedirect.com

Vibrational spectra have been obtained for 2-methylpentane (cas 107-83-5) and 3-methylpentane, and are interpreted with the aid of normal coordinate calculations. It is shown that 2-methylpentane exists in two molecular conformations and 3-methylpentane exists in four conformations. Transferred force constant values resulted in an overall average difference between observed and calculated wavenumbers of 5.0 cm−1 for the six conformers of these two compounds.

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