PM7 Accuracy

p2h4   2035 P2H4

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    #  Species Formula
  2025 Trimethylphosphine-Boron trifluorideH9BC3F3P
  2026 Phosphorus oxyfluorideOF3P
  2027 Phosphous oxyfluoride (Geo)OF3P
  2028 Phosphorus tetrafluorideF4P
  2029 Phosphorus tetrafluoride, anionF4P
  2030 Phosphorus pentafluoride (Geo)F5P
  2031 Phosphorus pentafluorideF5P
  2032 Phosphorus hexafluoride, anionF6P
  2033 Phosphorus dimer (Geo)P2
  2034 Phosphorus, dimerP2
  2035 P2H4 H4P2
  2036 Pyrophosphoric acid (Geo)H4O7P2
  2037 Pyrophosphoric acid (Geo)H4O7P2
  2038 Pyrophosphoric acidH4O7P2
  2039 P2F4 (Geo)F4P2
  2040 Methyl triphosphate anionCH6O10P3
  2041 Methyl triphosphate (Geo)CH7O10P3
  2042 Methyl triphosphateCH7O10P3
  2043 Phosphorus tetramer (Geo)P4
  2044 Phosphorus, tetramerP4
  2045 Phosphorus trioxide (Geo)O6P4


DHf: 5.0 kcal/mol,     REF: D. D. Wagman, W. H. Evans, V. B. Parker, R. H. Schumm, I. Halow, S. M. Bailey, K. L. Churney, R. L. Nuttall, J. Phys. Chem. Ref. Data Suppl. 11, 2 (1982).
Dipole: 0.9 Debye,     REF: J. R. Durig, L. A. Carreira, J. M. Odom, J. Am. Chem. Soc., 96, 2688 (1974)
  
 PM7
P2H4
 H=5.0 D=0.92 HR=WEPS1982 DR=DCO1974
  P     0.00000000  0    0.0000000  0    0.0000000  0     0     0     0
  P     2.21973851  1    0.0000000  0    0.0000000  0     1     0     0
  H     1.52507453  1   99.6721333  1    0.0000000  0     2     1     0
  H     1.52507625  1   99.6640665  1   77.9844253  1     1     2     3
  H     1.52506502  1   99.6556834  1  101.7456909  1     1     2     4
  H     1.52505685  1   99.6643516  1  101.7514215  1     2     1     3