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18 10 26 16 45

MP2/6-31G* for rPP

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


Differences greater than 0.110 are in the 0.110 bin. Differences less than -0.010 are in the -0.010 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
-0.010 0.000 0.010 0.020 0.030 0.040 0.050 0.060 0.070 0.080 0.090 0.100 0.110
bond length difference calc. - exp. (Å)

  Species Name Difference (Å)
Most negative difference P2H4 Diphosphine-0.008
Most positive difference P2+ phosphorus diatomic cation0.069

Bond lengths
Click on entry for experimental details.

Species Name Experimental (Å) Difference (Å)
P2H4 Diphosphine 2.219 -0.008
P4 Phosphorus tetramer 2.210 -0.005
P2 Phosphorus diatomic 1.893 0.014
P2+ phosphorus diatomic cation 1.986 0.069