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18 10 26 16 45

HF/LANL2DZ for rPCl

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
histogram chart 0 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 PCl3 Phosphorus trichloride0.160
Most positive difference PCl phosphorus chloride0.217

Bond lengths
Click on entry for experimental details.

Species Name Experimental (Å) Difference (Å)
PCl3 Phosphorus trichloride 2.043 0.160
Cl3PO Phosphoryl chloride 1.989 0.166
PCl5 Phosphorus pentachloride 2.020 0.171
PCl5 Phosphorus pentachloride 2.124 0.187
OPCl Phosphorus oxychloride 2.059 0.190
PCl phosphorus chloride 2.018 0.217