N~2~,N~2~-Dimethyl-N-{4-[(1-Methyl-2-Nitro-1H-Imidazol-5-Yl)Methoxy]Phenyl}Glycinamide

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Properties Simple | Detailed

Formula C15H19N5O4
IUPAC Name 2-(dimethylamino)-n-[4-[(3-methyl-2-nitro-imidazol-3-ium-4-ylium-4-yl)methoxy]phenyl]acetamide
Molecular Mass 333.342 g·mol−1
Heat of Formation -54.2 ± 16.7 kJ·mol−1
Dipole Moment 8.71 ± 1.08 D
Volume 392.24 Å 3
Surface Area 359.8 Å 2
HOMO Energy -8.84 ± 0.55 eV
LUMO Energy -0.99 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(dimethylamino)-4'-((1-methyl-2-nitroimidazole-5-yl)methoxy)acetanilide
  • 2-dimethylamino-n-[4-[(3-methyl-2-nitro-4-imidazolyl)methoxy]phenyl]acetamide
  • 2-dimethylamino-n-[4-[(3-methyl-2-nitro-imidazol-4-yl)methoxy]phenyl]acetamide
  • 2-dimethylamino-n-[4-[(3-methyl-2-nitro-imidazol-4-yl)methoxy]phenyl]ethanamide
  • 2-dimethylamino-n-[4-[(3-methyl-2-nitroimidazol-4-yl)methoxy]phenyl]acetamide
  • acetamide, 2-(dimethylamino)-n-(4-((1-methyl-2-nitro-1h-imidazol-5-yl)methoxy)phenyl)-
  • ro 15-0216
  • ro-15-0216
CAS Number(s)
  • 87544-68-1
InChIKey VBSQNHBYSYNMIG-UHFFFAOYSA-N
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