(3Ar,4S)-4-(2-Amino-4-Oxo-4H-Imidazol-5-Yl)-2-Bromo-4,5,6,7-Tetrahydropyrrolo[2,3-C]Azepin-8(3Ah)-One
Properties
| Property | Value |
|---|---|
| Formula | C11H10BrN5O2 |
| IUPAC Name | (3ar,4s)-4-(2-amino-5-oxo-imidazol-4-yl)-2-bromo-4,5,6,7-tetrahydro-3ah-pyrrolo[2,3-c]azepin-8-one |
| Molecular Mass | 324.133 g·mol−1 |
| Heat of Formation | 169.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 8.97 ± 1.08 D |
| Volume | 304.31 Å 3 |
| Surface Area | 271.3 Å 2 |
| HOMO Energy | -9.85 ± 0.55 eV |
| LUMO Energy | -1.75 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | QPCBNXNDVYOBIP-WHFBIAKZSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O Br N |