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18 10 26 16 45

PBEPBE/aug-cc-pVDZ for rBH

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 B2H6 Diborane0.006
Most positive difference BH Boron monohydride0.033

Bond lengths
Click on entry for experimental details.

Species Name Experimental (Å) Difference (Å)
B2H6 Diborane 1.200 0.006
B2H6 Diborane 1.320 0.012
HBO Boron hydride oxide 1.166 0.015
BH2NH2 Boranamine 1.195 0.016
BH3 boron trihydride 1.190 0.019
HBS hydrogen boron sulfide 1.169 0.020
BH3NH3 borane ammonia 1.206 0.021
BH Boron monohydride 1.232 0.033