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: Home > Geometry > Experimental > Same bond/angle many molecules OR Comparisons > Geometry > Bonds, angles > Same bond/angle many molecules

Compare Bonds

18 10 26 16 45

SVWN/6-31+G** for rOCl

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


Differences greater than 0.220 are in the 0.220 bin. Differences less than -0.020 are in the -0.020 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
-0.020 0.000 0.020 0.040 0.060 0.080 0.100 0.120 0.140 0.160 0.180 0.200 0.220
bond length difference calc. - exp. (Å)

  Species Name Difference (Å)
Most negative difference HClO4 perchloric acid0.037
Most positive difference ClOOCl Dichlorine dioxide0.156

Bond lengths
Click on entry for experimental details.

Species Name Experimental (Å) Difference (Å)
HClO4 perchloric acid 1.414 0.037
ClOF3 Chlorine trifluoride oxide 1.405 0.043
HClO4 perchloric acid 1.641 0.053
HClO4 perchloric acid 1.404 0.058
ClOOCl Dichlorine dioxide 1.704 0.156