IV.D.4. (XII.A.2.) |
Compare Bonds
18 10 19 16 31G3B3 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.
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8 | ||||||||||||||||||||||||||||||||||||||||
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4 | ||||||||||||||||||||||||||||||||||||||||
2 | ||||||||||||||||||||||||||||||||||||||||
0 | ||||||||||||||||||||||||||||||||||||||||
-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 | PH+ | phosphorus monohydride cation | 0.000 |
Most positive difference | HPO | Hydrogen phosphorus oxide | 0.037 |
Bond lengths
Click on entry for experimental details.
Species | Name | Experimental (Å) | Difference (Å) |
---|---|---|---|
PH+ | phosphorus monohydride cation | 1.435 | 0.000 |
CH3PH2 | Methyl phosphine | 1.423 | 0.003 |
PH2 | Phosphino radical | 1.428 | 0.003 |
PH3 | Phosphine | 1.421 | 0.003 |
P2H4 | Diphosphine | 1.417 | 0.008 |
P2H4 | Diphosphine | 1.414 | 0.009 |
CH2PH | Phosphaethene | 1.420 | 0.013 |
CH2PH | Phosphaethene | 1.420 | 0.013 |
PH | phosphorus monohydride | 1.422 | 0.014 |
PH | phosphorus monohydride | 1.422 | 0.015 |
PH | phosphorus monohydride | 1.422 | 0.015 |
PH3 | Phosphine | 1.421 | 0.035 |
HPO | Hydrogen phosphorus oxide | 1.433 | 0.037 |