2-[(2S)-2-Methyl-2-Pyrrolidinyl]-1H-Benzimidazole-4-Carboxamide

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Properties Simple | Detailed

Formula C13H17N4O
IUPAC Name 2-[(2s)-2-methylpyrrolidin-2-yl]-1h-benzimidazol-3-ium-7a-ide-4-carboxamide
Molecular Mass 245.300 g·mol−1
Heat of Formation 28.2 ± 16.7 kJ·mol−1
Dipole Moment 4.04 ± 1.08 D
Volume 293.86 Å 3
Surface Area 269.16 Å 2
HOMO Energy -9.18 ± 0.55 eV
LUMO Energy -0.77 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[(2s)-2-methylpyrrolidin-2-yl]-1h-benzimidazole-4-carboxamide
InChIKey JNAHVYVRKWKWKQ-ZDUSSCGKSA-N
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