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18 10 26 16 45

BLYP/cc-pCVTZ for rCCl

Histogram of Bond length differences (in Å) vs number of species


Differences greater than 0.055 are in the 0.055 bin. Differences less than -0.005 are in the -0.005 bin.

histogram chart 10
histogram chart 8
histogram chart 6
histogram chart 4
histogram chart 2
histogram chart 0 histogram chart histogram chart histogram chart histogram chart histogram chart
-0.005 0.000 0.005 0.010 0.015 0.020 0.025 0.030 0.035 0.040 0.045 0.050 0.055
bond length difference calc. - exp. (Å)

  Species Name Difference (Å)
Most negative difference CH2Cl chloromethyl radical0.023
Most positive difference CF2Cl2 difluorodichloromethane0.057

Bond lengths
Click on entry for experimental details.

Species Name Experimental (Å) Difference (Å)
CH2Cl chloromethyl radical 1.691 0.023
CH3Cl Methyl chloride 1.785 0.032
CH2Cl2 Methylene chloride 1.767 0.037
CF3Cl Methane, chlorotrifluoro- 1.752 0.045
CF2Cl2 difluorodichloromethane 1.744 0.057