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Compare Calculated Bonds for Cl-C

17 01 10 14 40

B97D3/aug-cc-pVQZ

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.

histogram chart 16 line line line line line line line line line line line line line line line line line line line line line line line line line line line line line line line line line line line line line line line
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histogram chart 4 line line line line line line line line line line line line line line line line line line line line line line line line line line line line line line line histogram chart line line line line line line line
histogram chart 2 line line line line line line line line line line histogram chart line line line line line line line line line line line line line line histogram chart line line line line line histogram chart line line line line line histogram chart line
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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
1.752 0.065

  Species Name Bond Length (Å)
Lowest value CH2Cl+ chloromethyl cation 1.600
Highest value CH2ClCCCl 1,3-dichloropropyne 1.834

Calculated Bond lengths
Click on entry for all calculated results.
Species Name Bond Length (Å) Atom1 index Atom2 index
CH2Cl+ chloromethyl cation 1.600 1 2
CH3Cl Methyl chloride 1.800 1 2
CH3Cl+ Methyl chloride cation 1.743 1 2
CFCl chlorofluoromethylene 1.776 1 3
CHCl2+ dichloromethyl cation 1.631 1 3
    1.631 1 4
CHFCl Chlorofluoromethyl radical 1.718 1 4
CHFCl+ Chlorofluoromethyl cation 1.615 1 4
CH2Cl2 Methylene chloride 1.787 1 4
    1.787 1 5
CH2BrCl Methane, bromochloro- 1.777 1 3
CFCl2 dichlorofluoromethyl radical 1.732 1 3
    1.732 1 4
CHCl3 Chloroform 1.783 1 3
    1.783 1 4
    1.783 1 5
CHFClBr fluorochlorobromomethane 1.776 1 3
CCl4 Carbon tetrachloride 1.787 1 2
    1.787 1 3
    1.787 1 4
    1.787 1 5
CF2Cl2 difluorodichloromethane 1.784 1 4
    1.784 1 5
CF3Cl Methane, chlorotrifluoro- 1.780 1 2
CH2ClCCCl 1,3-dichloropropyne 1.633 1 4
    1.834 3 5
CHCl2CCH 3,3-dichloropropyne 1.813 3 4
    1.813 3 5