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18 10 26 16 45

BLYP/cc-pVDZ 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 0 histogram chart 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 H2CSe Selenoformaldehyde0.023
Most positive difference CH3SeCH3 dimethylselenide0.050

Bond lengths
Click on entry for experimental details.

Species Name Experimental (Å) Difference (Å)
H2CSe Selenoformaldehyde 1.753 0.023
OCSe Carbonyl selenide 1.709 0.027
SCSe Carbon sulfide selenide 1.695 0.029
CSe2 Carbon diselenide 1.692 0.030
CSe Carbon monoselenide 1.676 0.034
CH3SeH Methane selenol 1.959 0.042
C4H4Se selenophene 1.855 0.045
CH3SeCH3 dimethylselenide 1.943 0.050