5-Isopropyl-1-Methyl-2-Nitro-1H-Imidazole

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Properties Simple | Detailed

Formula C7H11N3O2
IUPAC Name 5-isopropyl-1-methyl-2-nitro-imidazol-1-ium-5-ylium
Molecular Mass 169.181 g·mol−1
Heat of Formation 69.4 ± 16.7 kJ·mol−1
Dipole Moment 7.40 ± 1.08 D
Volume 202.49 Å 3
Surface Area 196.41 Å 2
HOMO Energy -9.87 ± 0.55 eV
LUMO Energy 2.10 ± eV
Point Group Symmetry C1
Synonyms
  • 1-methyl-2-nitro-5-propan-2-yl-imidazole
  • 1-methyl-2-nitro-5-propan-2-ylimidazole
  • 1-methyl-5-(1-methylethyl)-2-nitro-1h-imidazole
  • 1h-imidazole, 1-methyl-5-(1-methylethyl)-2-nitro- (9ci)
  • 5-isopropyl-1-methyl-2-nitro-imidazole
  • 5-isopropyl-1-methyl-2-nitroimidazole
  • dl 347
  • dl-347
  • imidazole, 5-isopropyl-1-methyl-2-nitro-
  • l 6347
CAS Number(s)
  • 23571-34-8
InChIKey NOXMCEHYBLYCTK-UHFFFAOYSA-N
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