N,N',1-Trimethyl-1H-Imidazole-4,5-Dicarboxamide

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Properties Simple | Detailed

Formula C8H12N4O2
IUPAC Name n4,n5,1-trimethylimidazol-1-ium-5-ylium-4,5-dicarboxamide
Molecular Mass 196.206 g·mol−1
Heat of Formation -215.1 ± 16.7 kJ·mol−1
Dipole Moment 5.28 ± 1.08 D
Volume 237.33 Å 3
Surface Area 227.96 Å 2
HOMO Energy -9.34 ± 0.55 eV
LUMO Energy -0.11 ± eV
Point Group Symmetry C1
Synonyms
  • 1-methylimidazole-4,5-bis-(carboxylic acid monomethylamide)
  • antiphein
  • imidazole-4,5-dicarboxamide, n,n',1-trimethyl-
CAS Number(s)
  • 880-90-0
InChIKey ARKTUMQGZIFBAJ-UHFFFAOYSA-N
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