3-[5-(1H-Imidazol-1-Yl)-7-Methyl-1H-Benzimidazol-2-Yl]-4-[(2-Pyridinylmethyl)Amino]-2(1H)-Pyridinone
Properties
Property | Value |
---|---|
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 |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
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Elements | H C O N |