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18 10 26 16 45

BLYP/6-31+G** for rCSe

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
histogram chart 0 histogram chart 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 OCSe Carbonyl selenide0.001
Most positive difference CH3SeCH3 dimethylselenide0.044

Bond lengths
Click on entry for experimental details.

Species Name Experimental (Å) Difference (Å)
OCSe Carbonyl selenide 1.709 0.001
CSe2 Carbon diselenide 1.692 0.008
H2CSe Selenoformaldehyde 1.753 0.009
SCSe Carbon sulfide selenide 1.695 0.011
CSe Carbon monoselenide 1.676 0.015
C4H4Se selenophene 1.855 0.028
CH3SeH Methane selenol 1.959 0.029
CH3SeCH3 dimethylselenide 1.943 0.044