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- 22:37, 3 November 2014 Rm1412 talk contribs uploaded File:FreqB3LYP6-31G(d)Hexadiene(anti2)IRspectrum0KRM1412.png (IR spectrum of ''anti 2'' 1, 5-hexadiene at 298K optimised with B3LYP/6-31G)
Hexadiene(anti2)IRspectrum0KRM1412.png){kind=link}