PM7 Accuracy

acetyl-urea   1286 Acetyl-urea

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    #  Species Formula
  1276 N,N-Dimethyl 4-methoxybenzamideC10H13NO2
  1277 1-NitroadamantaneC10H15NO2
  1278 2-NitroadamantaneC10H15NO2
  1279 Phenol, 2-[(phenylimino)methyl]-, N-oxideC13H11NO2
  1280 Benzenamine, N-[(4-methoxyphenyl)methylene]-, N-oxideC14H13NO2
  1281 N-(3-Phenoxy-2-hydroxypropyl)anilineC15H17NO2
  1282 NH2-NO2 (Geo)H2N2O2
  1283 OxalamideC2H4N2O2
  1284 HCONH2-HCONH2 (Geo)C2H6N2O2
  1285 N-NitrodimethylamineC2H6N2O2
  1286 Acetyl-urea C3H6N2O2
  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


DHf: -105.6 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
Acetyl-urea
 H=-105.6 HR=NIST
  C    -0.00819551  1  -0.00939865  1   0.00063014  1
  C     1.45334444  1   0.25546353  1  -0.00049696  1
  O     1.96279465  1   1.35227176  1   0.00757783  1
  N     2.36520901  1  -0.83411061  1  -0.01023771  1
  C     1.98255250  1  -2.18878291  1  -0.01939662  1
  O     0.82435783  1  -2.55353678  1  -0.01879961  1
  N     3.02753669  1  -3.09901739  1  -0.02832873  1
  H    -0.32271006  1  -0.60784456  1   0.87434827  1
  H    -0.32564280  1  -0.59564633  1  -0.88018950  1
  H    -0.57871087  1   0.93276888  1   0.00801994  1
  H     3.35337491  1  -0.58413103  1  -0.01047653  1
  H     3.98803069  1  -2.84436219  1  -0.03006165  1
  H     2.81229835  1  -4.07767483  1  -0.03521453  1