(1R,3As,8As)-5-{[(2-Ethylphenyl)Carbamoyl]Oxy}-1-Hydroxy-1,3A,8-Trimethyl-1,2,3,3A,8,8A-Hexahydropyrrolo[2,3-B]Indol-1-Ium
Properties
| Property | Value |
|---|---|
| Formula | C22H28N3O3+ |
| IUPAC Name | [(3r,8bs)-3-hydroxy-3,4,8b-trimethyl-2,3a-dihydro-1h-pyrrolo[2,3-b]indol-3-ium-7-yl] n-(2-ethylphenyl)carbamate |
| Molecular Mass | 382.476 g·mol−1 |
| Heat of Formation | -53.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.80 ± 1.08 D |
| Volume | 463.99 Å 3 |
| Surface Area | 398.74 Å 2 |
| HOMO Energy | -8.42 ± 0.55 eV |
| LUMO Energy | 2.91 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | AJWNTIIQZLHZRZ-HOKHCIIBSA-O |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |