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18 10 26 16 45

CCSD(T)=FULL/aug-cc-pVTZ for rCSe

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


Differences greater than 0.005 are in the 0.005 bin. Differences less than -0.007 are in the -0.007 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
-0.007 -0.006 -0.005 -0.004 -0.003 -0.002 -0.001 0.000 0.001 0.002 0.003 0.004 0.005
bond length difference calc. - exp. (Å)

  Species Name Difference (Å)
Most negative difference CH3SeCH3 dimethylselenide-0.007
Most positive difference CSe Carbon monoselenide0.004

Bond lengths
Click on entry for experimental details.

Species Name Experimental (Å) Difference (Å)
CH3SeCH3 dimethylselenide 1.943 -0.007
H2CSe Selenoformaldehyde 1.753 -0.003
C4H4Se selenophene 1.855 -0.003
SCSe Carbon sulfide selenide 1.695 -0.001
CSe2 Carbon diselenide 1.692 -0.001
OCSe Carbonyl selenide 1.709 -0.001
CSe Carbon monoselenide 1.676 0.004