Accuracy

dimethylformamide    928 Dimethylformamide

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    #  Species Formula
   918 Hydrogen isocyanate (Geo)HCNO
   919 Hydrogen isocyanateHCNO
   920 FormamideCH3NO
   921 Formamide (Geo)CH3NO
   922 AcetaldoximeC2H5NO
   923 AcetamideC2H5NO
   924 IsoxazoleC3H3NO
   925 OxaloneC3H3NO
   926 AcrylamineC3H5NO
   927 MethoxyacetonitrileC3H5NO
   928 Dimethylformamide C3H7NO
   929 N-Methyl acetamideC3H7NO
   930 PropanamideC3H7NO
   931 DimethylaminomethanolC3H9NO
   932 3-Methyl isoxazoleC4H5NO
   933 5-Methyl isoxazoleC4H5NO
   934 2-PyrrolidinoneC4H7NO
   935 4,5-Dihydro-2-methyl oxazoleC4H7NO
   936 MethacrylamideC4H7NO
   937 2-Methyl propanamideC4H9NO
   938 ButanamideC4H9NO


ΔHf: -45.8 kcal/mol,     REF: J. O. Cox, G. Pilcher, "Thermochemistry of Organic and Organometallic Compounds," Academic Press, New York, N.Y., 1970.
Dipole: 3.8 Debye,     REF: R. D. Nelson, D. R. Lide, A. A. Maryott, Nat. Stand. Ref. Data Set., Natl. Bur. Stand. No. 10 (1967).
  
 PM7
Dimethylformamide
 DR=NLM1967 D=3.82 H=-45.8 HR=C&P1970
  N     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.45841802 +1    0.0000000 +0    0.0000000 +0     1     0     0
  H     1.10600566 +1  110.7620979 +1    0.0000000 +0     2     1     0
  H     1.10289592 +1  111.5254816 +1  120.0410231 +1     2     1     3
  H     1.10596992 +1  110.7743677 +1 -119.9148971 +1     2     1     3
  C     1.45985974 +1  116.4423326 +1   60.0296800 +1     1     2     3
  H     1.10315116 +1  111.0368684 +1   60.3931700 +1     6     1     2
  H     1.11056561 +1  110.1710778 +1  119.2836785 +1     6     1     7
  H     1.10324948 +1  111.0088763 +1 -121.4480840 +1     6     1     7
  C     1.37452054 +1  122.3427445 +1  179.8408360 +1     1     2     6
  H     1.09850434 +1  116.5008371 +1    0.0543793 +1    10     1     2
  O     1.21606993 +1  120.7425750 +1  179.9958645 +1    10     1    11