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18 10 26 16 45

HF/6-31+G** for rCCl

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


Differences greater than 0.050 are in the 0.050 bin. Differences less than -0.010 are in the -0.010 bin.

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

  Species Name Difference (Å)
Most negative difference ClCOClCO Oxalyl chloride-0.010
Most positive difference C2Cl2 dichloroacetylene0.036

Bond lengths
Click on entry for experimental details.

Species Name Experimental (Å) Difference (Å)
ClCOClCO Oxalyl chloride 1.744 -0.010
CF3Cl Methane, chlorotrifluoro- 1.752 -0.008
CBrCl3 Methane, bromotrichloro- 1.765 -0.002
CCl4 Carbon tetrachloride 1.767 -0.000
CH3Cl Methyl chloride 1.785 -0.000
CH3CCl2CH3 Propane, 2,2-dichloro- 1.799 0.000
CHCl3 Chloroform 1.762 0.001
CH2ClCHO chloroacetaldehyde 1.782 0.001
CH2Cl2 Methylene chloride 1.767 0.002
C6H4Cl2 1,3-dichlorobenzene 1.736 0.005
CF2Cl2 difluorodichloromethane 1.744 0.006
CH2CClCHCH2 1,3-Butadiene, 2-chloro- 1.742 0.006
CHFClBr fluorochlorobromomethane 1.745 0.008
HCCl Chloromethylene 1.696 0.009
CH2BrCl Methane, bromochloro- 1.755 0.009
ClCN chlorocyanogen 1.629 0.010
CH2ClCCCl 1,3-dichloropropyne 1.638 0.011
HCCCl Chloroacetylene 1.637 0.011
CF2CCl2 difluorodichloroethylene 1.706 0.011
C6H4Cl2 1,4-dichlorobenzene 1.729 0.012
C2H2ClF 1-chloro-1-fluoroethylene 1.704 0.012
CBrClF2 Methane, bromochlorodifluoro- 1.736 0.013
CH2ClCCCl 1,3-dichloropropyne 1.779 0.014
CH3CHClCH3 Propane, 2-chloro- 1.798 0.018
CFCl chlorofluoromethylene 1.714 0.019
C6H5Cl chlorobenzene 1.725 0.019
CCl carbon monochloride 1.649 0.026
C2Cl2 dichloroacetylene 1.612 0.036