PM7 Accuracy

n,n-dimethyl-p-nitroaniline   1297 N,N-Dimethyl-p-nitroaniline

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    #  Species Formula
  1287 PropanediamideC3H6N2O2
  1288 Pyrazine-1,4-dioxideC4H4N2O2
  1289 UracilC4H4N2O2
  1290 ThymineC5H6N2O2
  1291 m-NitroanilineC6H6N2O2
  1292 p-NitroanilineC6H6N2O2
  1293 LysineC6H14N2O2
  1294 IsophthalamideC8H8N2O2
  1295 TeraphthalamideC8H8N2O2
  1296 N,N-Dimethyl-m-nitroanilineC8H10N2O2
  1297 N,N-Dimethyl-p-nitroaniline C8H10N2O2
  1298 TryptophanC11H12N2O2
  1299 Be(II)N2O2 (XEFSEG) (Geo)H16BeC22N2O2
  1300 Imidodicarbonic diamideC2H5N3O2
  1301 HistidineC6H9N3O2
  1302 ArgenineC6H14N4O2
  1303 Ozone (Geo)O3
  1304 OzoneO3
  1305 LiOH.2H2OH5LiO3
  1306 LiOH.2H2O (Geo)H5LiO3
  1307 Li(+)(H2O)3H6LiO3


DHf: 16.1 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-Dimethyl-p-nitroaniline
 H=16.1 HR=NIST
  C     0.00000000  0    0.0000000  0    0.0000000  0     0     0     0
  C     1.42336741  1    0.0000000  0    0.0000000  0     1     0     0
  C     1.37936428  1  120.3885062  1    0.0000000  0     2     1     0
  C     1.40305543  1  120.1160611  1   -0.0494928  1     3     2     1
  C     1.40318067  1  120.3368953  1   -0.0212237  1     4     3     2
  C     1.37912339  1  120.1285353  1    0.0333945  1     5     4     3
  N     1.36491029  1  120.6789363  1 -179.8484204  1     1     2     3
  N     1.43690443  1  119.8507736  1  179.9993757  1     4     3     5
  O     1.22359107  1  118.5569997  1   -0.0603981  1     8     4     3
  O     1.22360746  1  118.5419384  1 -179.9963581  1     8     4     9
  H     1.08448154  1  120.4003499  1  179.9916801  1     2     1     3
  H     1.09709951  1  120.3900349  1 -179.9895332  1     3     2     4
  C     1.46157338  1  121.4202631  1   -0.0241169  1     7     1     2
  H     1.08447529  1  119.2234724  1 -179.9959891  1     6     5     4
  H     1.09716287  1  119.4513931  1  179.9965900  1     5     4     6
  C     1.46158134  1  121.4133173  1 -179.7171008  1     7     1    13
  H     1.10714913  1  110.8620570  1  -60.7782956  1    13     7     1
  H     1.10721830  1  110.8404790  1  120.7801773  1    13     7    17
  H     1.10279767  1  111.4651589  1  119.5652107  1    13     7    18
  H     1.10717845  1  110.8452508  1  -60.5547277  1    16     7     1
  H     1.10715521  1  110.8637743  1  120.7937965  1    16     7    20
  H     1.10282084  1  111.4613244  1  119.6001501  1    16     7    21