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18 10 26 16 45

HF/STO-3G for rBB

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


Differences greater than 0.060 are in the 0.060 bin. Differences less than -0.060 are in the -0.060 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
-0.060 -0.050 -0.040 -0.030 -0.020 -0.010 -0.000 0.010 0.020 0.030 0.040 0.050 0.060
bond length difference calc. - exp. (Å)

  Species Name Difference (Å)
Most negative difference B2 Boron diatomic-0.059
Most positive difference B4H10 Tetraborane(10)0.049

Bond lengths
Click on entry for experimental details.

Species Name Experimental (Å) Difference (Å)
B2 Boron diatomic 1.590 -0.059
B2Cl4 Diboron tetrachloride 1.702 -0.013
B5H9 pentaborane9 1.687 -0.006
B4H10 Tetraborane(10) 1.705 0.013
B4H10 Tetraborane(10) 1.856 0.049