3-[5-(1H-Imidazol-1-Yl)-7-Methyl-1H-Benzimidazol-2-Yl]-4-[(2-Pyridinylmethyl)Amino]-2(1H)-Pyridinone

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Formula C22H20N7O+
IUPAC Name 3-(5-imidazol-1-yl-7-methyl-1h-benzimidazol-2-yl)-4-(2-pyridylmethylamino)-1h-pyridin-1-ium-2-one
Molecular Mass 398.441 g·mol−1
Heat of Formation 330.7 ± 16.7 kJ·mol−1
Dipole Moment 9.29 ± 1.08 D
Volume 455.78 Å 3
Surface Area 403.86 Å 2
HOMO Energy -8.49 ± 0.55 eV
LUMO Energy 2.08 ± eV
Point Group Symmetry C1
InChIKey GLTRPHMPCVLOJS-UHFFFAOYSA-N
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