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18 10 26 16 45

PBE1PBE/3-21G* for rBN

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


Differences greater than 0.022 are in the 0.022 bin. Differences less than -0.002 are in the -0.002 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
-0.002 0.000 0.002 0.004 0.006 0.008 0.010 0.012 0.014 0.016 0.018 0.020 0.022
bond length difference calc. - exp. (Å)

  Species Name Difference (Å)
Most negative difference NH3BF3 Amminetrifluoroboron0.000
Most positive difference BN boron nitride0.023

Bond lengths
Click on entry for experimental details.

Species Name Experimental (Å) Difference (Å)
NH3BF3 Amminetrifluoroboron 1.673 0.000
BH2NH2 Boranamine 1.391 0.009
BH3NH3 borane ammonia 1.645 0.021
BN boron nitride 1.325 0.023