Force constants for 3-chloropropyne and chloro-2-butyne |
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Authors: | GA Crowder |
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Institution: | Department of Chemistry and Killgore Research Center , West Texas State University , Canyon, Texas, 79015 |
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Abstract: | Normal coordinate calculations were carried out for H-C=C-CH2Cl using a valence force field and the force constants obtained were transferred to CH3-C=C-CH2Cl. There seem to be small but significant differences in some of the force constants of the -CH2Cl group of these two molecules. The vibrational assignment of McLachland 1] is confirmed, and the calculations show that the fundamental vibrations are relatively pure except for the C-C symmetric stretch and the skeletal bends. |
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