1-(4-Nitrophenyl)-2-Methyl-4-Nitroimidazole

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Properties Simple | Detailed

Formula C10H8N4O4
IUPAC Name 2-methyl-4-nitro-1-(4-nitrophenyl)imidazol-1-ium-2-ylium
Molecular Mass 248.195 g·mol−1
Heat of Formation 221.0 ± 16.7 kJ·mol−1
Dipole Moment 4.39 ± 1.08 D
Volume 266.39 Å 3
Surface Area 252.73 Å 2
HOMO Energy -10.42 ± 0.55 eV
LUMO Energy 0.79 ± eV
Point Group Symmetry C1
Synonyms
  • 1h-imidazole, 2-methyl-4-nitro-1-(4-nitrophenyl)-
  • 1h-imidazole, 2-methyl-4-nitro-1-(4-nitrophenyl)- (9ci)
  • altimol
  • bt-985
  • emd 15700
  • emd-15,700
  • emd-15-700
  • imidazole, 2-methyl-4-nitro-1-(p-nitrophenyl)-
  • nitrefazole
  • nitrefazole [ban:inn]
CAS Number(s)
  • 21721-92-6
InChIKey NMTBSNPBIGRZBL-UHFFFAOYSA-N
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