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18 10 26 16 45

MP4/3-21G for rCSe

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
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 CH3SeH Methane selenol0.047
Most positive difference CSe Carbon monoselenide0.160

Bond lengths
Click on entry for experimental details.

Species Name Experimental (Å) Difference (Å)
CH3SeH Methane selenol 1.959 0.047
OCSe Carbonyl selenide 1.709 0.050
CH3SeCH3 dimethylselenide 1.943 0.058
SCSe Carbon sulfide selenide 1.695 0.061
C4H4Se selenophene 1.855 0.067
CSe2 Carbon diselenide 1.692 0.067
CSe Carbon monoselenide 1.676 0.160