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18 10 26 16 45

B97D3/cc-pVTZ for rPH

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
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 PH2 Phosphino radical0.003
Most positive difference HPO Hydrogen phosphorus oxide0.045

Bond lengths
Click on entry for experimental details.

Species Name Experimental (Å) Difference (Å)
PH2 Phosphino radical 1.428 0.003
CH3PH2 Methyl phosphine 1.423 0.003
PH3 Phosphine 1.421 0.007
PH+ phosphorus monohydride cation 1.435 0.007
P2H4 Diphosphine 1.417 0.008
P2H4 Diphosphine 1.414 0.009
PH phosphorus monohydride 1.422 0.014
CH2PH Phosphaethene 1.420 0.015
HPO Hydrogen phosphorus oxide 1.433 0.045