Accuracy

1,1-dichloro-1-nitro-propane   1767 1,1-Dichloro-1-nitro-propane

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    #  Species Formula
  1757 1,2-DichlorobenzeneC6H4Cl2
  1758 1,3-DichlorobenzeneC6H4Cl2
  1759 1,4-DichlorobenzeneC6H4Cl2
  1760 Chlorine monoxideOCl2
  1761 Cl2O (Geo)OCl2
  1762 Carbonyl chlorideCOCl2
  1763 Carbonyl chloride (Geo)COCl2
  1764 Cl2O2O2Cl2
  1765 Oxalyl chlorideC2O2Cl2
  1766 Oxalyl chloride (Geo)C2O2Cl2
  1767 1,1-Dichloro-1-nitro-propane C3H5NO2Cl2
  1768 Chlorine heptoxideO7Cl2
  1769 1,1',2,2'-Tetranitro-1,2-dichloroethaneC2N4O8Cl2
  1770 1,3-Dichloro-1,1,3,3-tetranitropropaneC3H2N4O8Cl2
  1771 FluorodichloromethaneHCFCl2
  1772 Dichlorodifluoromethane (Geo)CF2Cl2
  1773 DifluorodichloromethaneCF2Cl2
  1774 1,2-Dichloro 1,1,2,2-tetrafluoroethaneC2F4Cl2
  1775 PCl2(C2H5)C2H5PCl2
  1776 OPCl2OPCl2
  1777 MethylphosphonodichlorideCH3OPCl2


ΔHf: -40.2 kcal/mol,     REF: NIST Chemistry WebBook, NIST Standard Reference Database, No. 69; W. G. Mallard, P. J. Linstrom, Eds., National Institute of Standards and Technology, Gaithersberg, http://webbook.nist.gov/chemistry.
  

1,1-Dichloro-1-nitro-propane
 H=-40.2 HR=NIST
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.52530443 +1    0.0000000 +0    0.0000000 +0     1     0     0
  C     1.51453783 +1  112.4289476 +1    0.0000000 +0     2     1     0
  N     1.52555317 +1  112.4178315 +1  -65.8034267 +1     3     2     1
 Cl     1.77351755 +1  109.8265801 +1 -117.0714692 +1     3     2     4
 Cl     1.75760122 +1  111.4537287 +1 -119.6533781 +1     3     2     5
  O     1.21535583 +1  115.8957086 +1  -36.0555581 +1     4     3     2
  O     1.21128952 +1  118.3622681 +1 -179.0503287 +1     4     3     7
  H     1.09864716 +1  112.1760448 +1   57.0016438 +1     1     2     3
  H     1.09948308 +1  110.7082443 +1  118.7215456 +1     1     2     9
  H     1.09731941 +1  112.8051086 +1  119.3892961 +1     1     2    10
  H     1.11842257 +1  109.3737376 +1 -122.3715987 +1     2     1     3
  H     1.11477268 +1  109.6715276 +1 -114.6781126 +1     2     1    12