N-[4-[(6-Aminopurine-1,3,7-Triium-9-Yl)Methyl]Phenyl]-2-Bromo-Acetamide
Properties
| Property | Value |
|---|---|
| Formula | C14H13BrN6O |
| IUPAC Name | n-[4-[(6-aminopurine-1,3,7-triium-9-yl)methyl]phenyl]-2-bromo-acetamide |
| Molecular Mass | 361.197 g·mol−1 |
| Heat of Formation | 195.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.05 ± 1.08 D |
| Volume | 357.23 Å 3 |
| Surface Area | 326.24 Å 2 |
| HOMO Energy | -8.89 ± 0.55 eV |
| LUMO Energy | 2.47 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | TXSIEHSJECUQLL-UHFFFAOYSA-O |
| QR Code | Generate QR Code |
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| Elements | H C O Br N |