Accuracy

phosphorus oxychloride   1798 Phosphorus oxychloride

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    #  Species Formula
  1788 TrichloroethyleneHC2Cl3
  1789 1,1,1-TrichloroethaneC2H3Cl3
  1790 1,2,2-TrichloroethaneC2H3Cl3
  1791 1,2,3-TrichlorobenzeneC6H3Cl3
  1792 1,2,4-TrichlorobenzeneC6H3Cl3
  1793 1,3,5-TrichlorobenzeneC6H3Cl3
  1794 TrichloroacetaldehydeHC2OCl3
  1795 Trichlorofluoromethane (Geo)CFCl3
  1796 FluorotrichloromethaneCFCl3
  1797 1,1',2-Trichloro-1,2,2'-trifluoroethaneC2F3Cl3
  1798 Phosphorus oxychloride OPCl3
  1799 Phosphorus oxychloride (Geo)OPCl3
  1800 SOCl3OSCl3
  1801 Carbon tetrachlorideCCl4
  1802 Carbon tetrachloride (Geo)CCl4
  1803 Tetrachloroethylene (Geo)C2Cl4
  1804 TetrachloroethyleneC2Cl4
  1805 1,1,2,2-TetrachloroethaneC2H2Cl4
  1806 1,2,2,2-TetrachloroethaneC2H2Cl4
  1807 1,2,3,4-TetrachlorobenzeneC6H2Cl4
  1808 1,2,3,5-TetrachlorobenzeneC6H2Cl4


ΔHf: -132.8 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).
I.P.: 11.8 eV,     REF: R. D. Levin, S. G. Lias, "Ionization Potentials and Appearance Potential Measurements," 1971-1981, Natl. Stand. Ref. Data Ser., Natl. Bur. Stand. 71, (1982), Cat. No. C13.48:71.
  
 SYMMETRY
Phosphorus oxychloride
 H=-132.8 HR=WEPS1982 I=11.85 IR=LLNBS82 S=77.80 CP=20.29
 
  O     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  P     1.46494706 +1    0.0000000 +0    0.0000000 +0     1     0     0
 Cl     1.87708589 +1  112.4559057 +1    0.0000000 +0     2     1     0
 Cl     1.87708589 +1  112.4559057 +1  120.0000000 +1     2     1     3
 Cl     1.87708589 +1  112.4559057 +1 -120.0000000 +1     2     1     3
 
   3  1    4    5
   3  2    4    5