PM7 Accuracy

n,n-diethyl acetamide    968 N,N-Diethyl acetamide

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    #  Species Formula
   958 3-Hydroxy-2-methylpyridineC6H7NO
   959 3-Hydroxy-6-methylpyridineC6H7NO
   960 4-Hydroxy-2-methylpyridineC6H7NO
   961 6-Methyl-2(1H)-pyridinoneC6H7NO
   962 m-Amino phenolC6H7NO
   963 o-Amino phenolC6H7NO
   964 p-Amino phenolC6H7NO
   965 Trimethyl isoxazoleC6H9NO
   966 CaprolactamC6H11NO
   967 Cyclohexanone oximeC6H11NO
   968 N,N-Diethyl acetamide C6H13NO
   969 N,N-DimethylbutyramineC6H13NO
   970 BenzoxazoleC7H5NO
   971 IsocyanatobenzeneC7H5NO
   972 BenzamideC7H7NO
   973 N,N-Dimethylamino-2,4-pentadiene-5-alC7H11NO
   974 2-Methoxy-3,3-dimethylbutanenitrileC7H13NO
   975 N,N-DiethylaminoacetoneC7H15NO
   976 N,N-Dimethyl-tert-butylcarboxamideC7H15NO
   977 alpha-oxo BenzeneacetonitrileC8H5NO
   978 1,3-dimethyl-2-nitroso-benzeneC8H9NO


DHf: -68.6 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.
  
 PM7
N,N-Diethyl acetamide
 H=-68.64 HR=NIST
  N    -0.04297018  1   0.00790164  1   0.02441866  1
  C     1.05134444  1  -0.04015595  1   0.87920598  1
  C     1.78351392  1   1.23617761  1   1.19310889  1
  C    -0.75059059  1   1.25690609  1  -0.26587664  1
  C    -1.60666039  1   1.76499985  1   0.90195621  1
  C    -0.76228640  1  -1.25229328  1  -0.22682751  1
  C    -1.64780643  1  -1.69442815  1   0.94356227  1
  O     1.44257742  1  -1.11651589  1   1.28866529  1
  H     2.14109642  1   1.73609811  1   0.28361849  1
  H     1.16531532  1   1.94396991  1   1.75690327  1
  H     2.66821154  1   1.00924091  1   1.81202745  1
  H    -0.00606956  1   2.03348882  1  -0.55784980  1
  H    -1.39402654  1   1.10093138  1  -1.16297417  1
  H    -2.39746927  1   1.05130460  1   1.16067826  1
  H    -1.01045386  1   1.92299477  1   1.80723854  1
  H    -2.08997475  1   2.71478022  1   0.64913228  1
  H    -1.36552419  1  -1.14203226  1  -1.15350204  1
  H     0.00337373  1  -2.04413265  1  -0.42888596  1
  H    -1.05089765  1  -1.79269267  1   1.86230852  1
  H    -2.45491756  1  -0.98488375  1   1.14261415  1
  H    -2.09948263  1  -2.67209032  1   0.74378004  1