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18 10 26 16 45

LSDA/6-31G for rFP

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


Differences greater than 0.220 are in the 0.220 bin. Differences less than -0.020 are in the -0.020 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
-0.020 0.000 0.020 0.040 0.060 0.080 0.100 0.120 0.140 0.160 0.180 0.200 0.220
bond length difference calc. - exp. (Å)

  Species Name Difference (Å)
Most negative difference PF5 Phosphorus pentafluoride0.105
Most positive difference PF+ phosphorus monofluoride cation0.154

Bond lengths
Click on entry for experimental details.

Species Name Experimental (Å) Difference (Å)
PF5 Phosphorus pentafluoride 1.577 0.105
PF phosphorus monofluoride 1.593 0.125
PF3 Phosphorus trifluoride 1.561 0.137
F3PO Phosphoryl fluoride 1.524 0.144
PF+ phosphorus monofluoride cation 1.500 0.154