1-Ethyl-N~5~-Methyl-1H-Imidazole-4,5-Dicarboxamide

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Properties Simple | Detailed

Formula C8H12N4O2
IUPAC Name 1-ethyl-n5-methyl-imidazol-1-ium-5-ylium-4,5-dicarboxamide
Molecular Mass 196.206 g·mol−1
Heat of Formation -280.5 ± 16.7 kJ·mol−1
Dipole Moment 2.38 ± 1.08 D
Volume 229.86 Å 3
Surface Area 219.31 Å 2
HOMO Energy -9.57 ± 0.55 eV
LUMO Energy -0.43 ± eV
Point Group Symmetry C1
Synonyms
  • 1-ethyl-4-carbamoyl-5-methylcarbamoylimidazole
  • 1-ethyl-n'-methyl-imidazole-4,5-dicarboxamide
  • 1-ethyl-n'-methylimidazole-4,5-dicarboxamide
  • 1-ethyl-n(sup 5)-methyl-1h-imidazole-4,5-dicarboxamide
  • 1h-imidazole-4,5-dicarboxamide, 1-ethyl-n(sup 5)-methyl-
  • desmethyletimizol
CAS Number(s)
  • 85275-59-8
InChIKey HMGGQLSRJXFGRN-UHFFFAOYSA-N
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