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

B97D3/6-31G(2df,p) for rNN

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


Differences greater than 0.110 are in the 0.110 bin. Differences less than -0.010 are in the -0.010 bin.

histogram chart 10
histogram chart 8
histogram chart 6
histogram chart 4
histogram chart 2 histogram chart
histogram chart 0 histogram chart histogram chart histogram chart
-0.010 0.000 0.010 0.020 0.030 0.040 0.050 0.060 0.070 0.080 0.090 0.100 0.110
bond length difference calc. - exp. (Å)

  Species Name Difference (Å)
Most negative difference N2H4 Hydrazine0.001
Most positive difference N2O4 Dinitrogen tetroxide0.102

Bond lengths
Click on entry for experimental details.

Species Name Experimental (Å) Difference (Å)
N2H4 Hydrazine 1.446 0.001
N3 azide radical 1.181 0.005
N2 Nitrogen diatomic 1.098 0.009
HN3 hydrogen azide 1.133 0.010
N2O Nitrous oxide 1.128 0.011
N2O4 Dinitrogen tetroxide 1.782 0.102