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18 10 26 16 45

MP4=FULL/6-311+G(3df,2p) for rSO

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


Differences greater than 0.022 are in the 0.022 bin. Differences less than -0.002 are in the -0.002 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
-0.002 0.000 0.002 0.004 0.006 0.008 0.010 0.012 0.014 0.016 0.018 0.020 0.022
bond length difference calc. - exp. (Å)

  Species Name Difference (Å)
Most negative difference HOSH hydrogen thioperoxide0.013
Most positive difference SO2 Sulfur dioxide0.022

Bond lengths
Click on entry for experimental details.

Species Name Experimental (Å) Difference (Å)
HOSH hydrogen thioperoxide 1.662 0.013
C2H6O2S Dimethyl sulfone 1.431 0.015
SO3 Sulfur trioxide 1.418 0.017
SO2 Sulfur dioxide 1.432 0.022