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

HF/CEP-121G for rCSi

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 SiCl3CH3 methyltrichlorosilane0.036
Most positive difference SiC silicon monocarbide0.121

Bond lengths
Click on entry for experimental details.

Species Name Experimental (Å) Difference (Å)
SiCl3CH3 methyltrichlorosilane 1.848 0.036
SiC2 Silicon dicarbide 1.836 0.102
SiC silicon monocarbide 1.722 0.121