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Compare Calculated Bonds for C-Cl

17 01 10 14 40

MP4/Def2TZVPP

Histogram of Bond lengths (in Å) vs number of species


Values greater than 1.82 are in the 1.82 bin. Values less than 1.58 are in the 1.58 bin.

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1.58 1.60 1.62 1.64 1.66 1.68 1.70 1.72 1.74 1.76 1.78 1.80 1.82
bond lengths (Å)

Summary: (Å)
Average bond length Standard deviation
1.714 0.067

  Species Name Bond Length (Å)
Lowest value CH2Cl+ chloromethyl cation 1.594
Highest value CH2ClCCCl 1,3-dichloropropyne 1.800

Calculated Bond lengths
Click on entry for all calculated results.
Species Name Bond Length (Å) Atom1 index Atom2 index
CH2Cl+ chloromethyl cation 1.594 1 2
CH3Cl Methyl chloride 1.785 1 2
CHCl2+ dichloromethyl cation 1.628 1 3
    1.628 1 4
CHFCl Chlorofluoromethyl radical 1.709 1 4
CHFCl+ Chlorofluoromethyl cation 1.608 1 4
CH2Cl2 Methylene chloride 1.774 1 4
    1.774 1 5
CH2BrCl Methane, bromochloro- 1.770 1 3
CFCl2 dichlorofluoromethyl radical 1.720 1 3
    1.720 1 4
CHCl2CHO dichloroacetaldehyde 1.787 1 4
    1.758 1 5
CH2ClCCCl 1,3-dichloropropyne 1.643 1 4
    1.800 3 5
CH2CClCHCH2 1,3-Butadiene, 2-chloro- 1.745 2 5
C2ClF3 Ethene, chlorotrifluoro- 1.703 2 6