N,N-Dimethyl-2-(2-Nitro-1H-Imidazol-1-Yl)Acetamide

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Properties Simple | Detailed

Formula C7H10N4O3
IUPAC Name n,n-dimethyl-2-(2-nitroimidazol-1-ium-2-ylium-1-yl)acetamide
Molecular Mass 198.179 g·mol−1
Heat of Formation -13.1 ± 16.7 kJ·mol−1
Dipole Moment 4.65 ± 1.08 D
Volume 224.32 Å 3
Surface Area 210.73 Å 2
HOMO Energy -9.80 ± 0.55 eV
LUMO Energy -1.17 ± eV
Point Group Symmetry C1
Synonyms
  • 1h-imidazole-1-acetamide, n,n-dimethyl-2-nitro-
  • imidazole-1-acetamide, n,n-dimethyl-2-nitro-
  • kin 806
  • n,n-dimethyl-2-(2-nitro-1-imidazolyl)acetamide
  • n,n-dimethyl-2-(2-nitroimidazol-1-yl)acetamide
  • n,n-dimethyl-2-(2-nitroimidazol-1-yl)ethanamide
  • n,n-dimethyl-2-nitro-1-imidazoleacetamide
CAS Number(s)
  • 22668-03-7
InChIKey NXUUXBZRCPNIBU-UHFFFAOYSA-N
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