Accuracy

methyldinitramine   1218 Methyldinitramine

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    #  Species Formula
  1208 Dinitrogen tetroxide (Geo)N2O4
  1209 DinitromethaneCH2N2O4
  1210 m-DinitrobenzeneC6H4N2O4
  1211 o-DinitrobenzeneC6H4N2O4
  1212 p-DinitrobenzeneC6H4N2O4
  1213 DinitrophenylmethaneC7H6N2O4
  1214 2,4-DinitrotolueneC7H6N2O4
  1215 N,N'-Bis(m-methoxyphenyl) terephthalamideC22H20N2O4
  1216 N,N'-Bis(o-methoxyphenyl) terephthalamideC22H20N2O4
  1217 N,N'-Bis(p-methoxyphenyl) terephthalamideC22H20N2O4
  1218 Methyldinitramine CH3N3O4
  1219 Tartronic acidC3H4O5
  1220 1,3,5,7,9-pentaoxecaneC5H10O5
  1221 3,5,7,9,11-Pentaoxa-tridecaneC8H18O5
  1222 15-Crown-5C10H20O5
  1223 Dinitrogen pentoxideN2O5
  1224 Trimethyl methanetricarboxylateC7H10O6
  1225 Triethyl methanetricarboxylateC10H16O6
  1226 Triethyl 1,1,1-ethanetricarboxylateC11H18O6
  1227 Trinitromethane (Geo)HCN3O6
  1228 TrinitromethaneHCN3O6


ΔHf: 10.3 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.
  

Methyldinitramine
 H=10.3 HR=NIST
  C     0.05901281 +1  -0.00702396 +1   0.05517040 +1
  N     1.54140590 +1  -0.01148074 +1   0.01911340 +1
  N     2.15696365 +1   1.27035520 +1   0.02803847 +1
  N     2.12944511 +1  -1.06914429 +1  -0.73110473 +1
  O     1.33878994 +1  -1.91335682 +1  -1.09611476 +1
  O     3.32443439 +1  -1.06231255 +1  -0.86281321 +1
  O     1.40713048 +1   2.17513880 +1   0.32868600 +1
  O     3.33843478 +1   1.32683822 +1  -0.18981058 +1
  H    -0.29925219 +1  -1.01021380 +1   0.35844868 +1
  H    -0.39522810 +1   0.25497085 +1  -0.91432497 +1
  H    -0.28859445 +1   0.71472368 +1   0.82091546 +1