(4Ar,5As,6R,8As,13As,15As,15Br)-6-Oxido-4A,5,5A,7,8,13A,15,15A,15B,16-Decahydro-2H-4,6-Methanoindolo[3,2,1-Ij]Oxepino[2,3,4-De]Pyrrolo[2,3-H]Quinoline-6-Ium-14-One
Properties
| Property | Value |
|---|---|
| Formula | C21H23N2O3+ |
| IUPAC Name | (4ar,5as,6r,8as,13as,15as,15br)-6-oxido-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2h-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinoline-6-ium-14-one |
| Molecular Mass | 351.419 g·mol−1 |
| Heat of Formation | -124.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.38 ± 1.08 D |
| Volume | 390.98 Å 3 |
| Surface Area | 306.36 Å 2 |
| HOMO Energy | -8.77 ± 0.55 eV |
| LUMO Energy | 2.95 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | RMSRBUAAZSNQJZ-OJNQZCLCSA-N |
| QR Code | Generate QR Code |
| Links | PubChem |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |