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18 10 26 16 45

MP2/3-21G for rBN

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
-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 BN boron nitride0.008
Most positive difference BH3NH3 borane ammonia0.057

Bond lengths
Click on entry for experimental details.

Species Name Experimental (Å) Difference (Å)
BN boron nitride 1.325 0.008
BH2NH2 Boranamine 1.391 0.019
B3N3H6 borazine 1.436 0.019
NH3BF3 Amminetrifluoroboron 1.673 0.030
BH3NH3 borane ammonia 1.645 0.057