2-(3'-Carbamimidoyl-4-Biphenylyl)-1H-Benzimidazole-6-Carboximidamide

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Properties Simple | Detailed

Formula C21H18N6
IUPAC Name 2-[4-(3-carbamimidoylphenyl)phenyl]benzimidazol-1-ium-5-carboxamidine
Molecular Mass 354.408 g·mol−1
Heat of Formation 558.5 ± 16.7 kJ·mol−1
Dipole Moment 6.88 ± 1.08 D
Volume 422.14 Å 3
Surface Area 387.21 Å 2
HOMO Energy -9.23 ± 0.55 eV
LUMO Energy 0.94 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[4-(3-amidinophenyl)phenyl]-3h-benzimidazole-5-carboxamidine
  • 2-[4-(3-carbamimidoylphenyl)phenyl]-3h-benzimidazole-5-carboxamidine
  • 2-[4-(3-carbamimidoylphenyl)phenyl]-3h-benzimidazole-5-carboximidamide
InChIKey JTEAXLWMBHFLPI-UHFFFAOYSA-N
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Elements H C N