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18 10 26 16 45

MP3=FULL/6-31G* for rCSe

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


Differences greater than 0.012 are in the 0.012 bin. Differences less than -0.012 are in the -0.012 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 histogram chart
-0.012 -0.010 -0.008 -0.006 -0.004 -0.002 0.000 0.002 0.004 0.006 0.008 0.010 0.012
bond length difference calc. - exp. (Å)

  Species Name Difference (Å)
Most negative difference CSe2 Carbon diselenide-0.011
Most positive difference CH3SeCH3 dimethylselenide0.008

Bond lengths
Click on entry for experimental details.

Species Name Experimental (Å) Difference (Å)
CSe2 Carbon diselenide 1.692 -0.011
SCSe Carbon sulfide selenide 1.695 -0.009
CSe Carbon monoselenide 1.676 -0.006
CH3SeH Methane selenol 1.959 0.000
OCSe Carbonyl selenide 1.709 0.001
C4H4Se selenophene 1.855 0.007
CH3SeCH3 dimethylselenide 1.943 0.008