return to home page Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
You are here: Calculated > Geometry > Calculated geometry > One type of bond

Compare Calculated Bonds for Cl-H

17 01 10 14 40

HF/CEP-121G

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


Values greater than 3.60 are in the 3.60 bin. Values less than 1.20 are in the 1.20 bin.

histogram chart 7 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
histogram chart 6 line line line line histogram chart 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
histogram chart 5 line line line line histogram chart 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
histogram chart 4 line line line line histogram chart 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
histogram chart 3 line line line line histogram chart 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
histogram chart 2 line line line line histogram chart 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
histogram chart 1 line line line line histogram chart 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
histogram chart 0 line line line line histogram chart line line line line line histogram chart 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
1.20 1.40 1.60 1.80 2.00 2.20 2.40 2.60 2.80 3.00 3.20 3.40 3.60
bond lengths (Å)

Summary: (Å)
Average bond length Standard deviation
1.633 0.709

  Species Name Bond Length (Å)
Lowest value HCl Hydrogen chloride 1.306
Highest value HCl- hydrogen chloride anion 3.597

Calculated Bond lengths
Click on entry for all calculated results.
Species Name Bond Length (Å) Atom1 index Atom2 index
HCl- hydrogen chloride anion 3.597 1 2
HCl Hydrogen chloride 1.306 1 2
HCl+ hydrogen chloride cation 1.349 1 2
DCl Hydrochloric acid-d 1.306 1 2
H2Cl+ dihydrogen monochloride cation 1.334 1 2
    1.334 1 3
Cl2H+ Chlorine, protonated 1.332 2 3
FClH+ Chlorine fluoride, Cl-protonated 1.347 2 3
NH4Cl Ammonium chloride 1.790 2 6