9-Cyclopentyl-N-(5-Piperazin-1-Ylpyridin-1-Ium-5-Id-2-Yl)Pyrido[3,4]Pyrrolo[1,3-D]Pyrimidine-1,3,7-Triium-4A,8A-Diid-2-Amine
Properties
| Property | Value |
|---|---|
| Formula | C23H28N8 |
| IUPAC Name | 9-cyclopentyl-n-(5-piperazin-1-ylpyridin-1-ium-5-id-2-yl)pyrido[3,4]pyrrolo[1,3-d]pyrimidine-1,3,7-triium-4a,8a-diid-2-amine |
| Molecular Mass | 416.522 g·mol−1 |
| Heat of Formation | 507.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.81 ± 1.08 D |
| Volume | 492.29 Å 3 |
| Surface Area | 428.77 Å 2 |
| HOMO Energy | -8.42 ± 0.55 eV |
| LUMO Energy | 1.05 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | ZTZOZJXTZOVNBM-UHFFFAOYSA-O |
| QR Code | Generate QR Code |
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| Elements | H C N |