Accuracy

teraphthalamide   1292 Teraphthalamide

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    #  Species Formula
  1282 N-NitrodimethylamineC2H6N2O2
  1283 Acetyl-ureaC3H6N2O2
  1284 PropanediamideC3H6N2O2
  1285 Pyrazine-1,4-dioxideC4H4N2O2
  1286 UracilC4H4N2O2
  1287 ThymineC5H6N2O2
  1288 m-NitroanilineC6H6N2O2
  1289 p-NitroanilineC6H6N2O2
  1290 LysineC6H14N2O2
  1291 IsophthalamideC8H8N2O2
  1292 Teraphthalamide C8H8N2O2
  1293 N,N-Dimethyl-m-nitroanilineC8H10N2O2
  1294 N,N-Dimethyl-p-nitroanilineC8H10N2O2
  1295 TryptophanC11H12N2O2
  1296 Be(II)N2O2 (XEFSEG) (Geo)H16BeC22N2O2
  1297 Imidodicarbonic diamideC2H5N3O2
  1298 HistidineC6H9N3O2
  1299 ArgenineC6H14N4O2
  1300 Ozone (Geo)O3
  1301 OzoneO3
  1302 LiOH.2H2OH5LiO3


ΔHf: -69.7 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
Teraphthalamide
 H=-69.7 HR=NIST
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.39411691 +1    0.0000000 +0    0.0000000 +0     1     0     0
  C     1.39286415 +1  119.4838474 +1    0.0000000 +0     2     1     0
  C     1.39482688 +1  119.5601566 +1    0.3813628 +1     3     2     1
  C     1.39385833 +1  120.9618425 +1   -0.3452048 +1     4     3     2
  C     1.39311438 +1  119.4694428 +1    0.4199213 +1     5     4     3
  C     1.48949656 +1  120.9402338 +1 -178.6424812 +1     1     2     3
  O     1.21307698 +1  123.4174537 +1  127.0196546 +1     7     1     2
  N     1.38226698 +1  116.5487772 +1  179.6836519 +1     7     1     8
  C     1.48963080 +1  118.0943756 +1 -178.1534821 +1     4     3     5
  O     1.21307392 +1  123.4106259 +1   52.1688084 +1    10     4     3
  N     1.38225962 +1  116.5123977 +1 -179.6734999 +1    10     4    11
  H     1.08991610 +1  120.4867214 +1  179.4325252 +1     2     1     3
  H     1.09198435 +1  120.4937450 +1 -179.3405664 +1     3     2     4
  H     1.08989543 +1  120.5366954 +1 -179.4623899 +1     5     4     6
  H     1.09209242 +1  120.4444258 +1  178.9495285 +1     6     5     4
  H     0.99540175 +1  122.7396439 +1   -4.3894440 +1     9     7     1
  H     1.00108675 +1  119.8781134 +1 -174.1728642 +1     9     7    17
  H     0.99540144 +1  122.7289653 +1    4.0875095 +1    12    10     4
  H     1.00112786 +1  119.8902566 +1  174.3531066 +1    12    10    19