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18 10 26 16 45

M06-2X/6-31+G** for rOCl

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


Differences greater than 0.055 are in the 0.055 bin. Differences less than -0.005 are in the -0.005 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 histogram chart
-0.005 0.000 0.005 0.010 0.015 0.020 0.025 0.030 0.035 0.040 0.045 0.050 0.055
bond length difference calc. - exp. (Å)

  Species Name Difference (Å)
Most negative difference ClOOCl Dichlorine dioxide0.013
Most positive difference HClO4 perchloric acid0.041

Bond lengths
Click on entry for experimental details.

Species Name Experimental (Å) Difference (Å)
ClOOCl Dichlorine dioxide 1.704 0.013
HClO4 perchloric acid 1.641 0.014
CH3OCl methyl hypochlorite 1.674 0.020
HClO4 perchloric acid 1.414 0.021
ClOF3 Chlorine trifluoride oxide 1.405 0.026
HClO4 perchloric acid 1.404 0.041