N-(Diphenylmethyl)-6-{[2-(Methyleneamino)Butanoyl]Amino}-5-Oxo-1,2,3,5,6,9,10,10A-Octahydropyrrolo[1,2-A]Azocine-3-Carboxamide
Properties
| Property | Value |
|---|---|
| Formula | C29H34N4O3 |
| IUPAC Name | (3s,6s,10as)-n-benzhydryl-6-[[(2s)-2-(methyleneamino)butanoyl]amino]-5-oxo-2,3,6,9,10,10a-hexahydro-1h-pyrrolo[1,2-a]azocine-3-carboxamide |
| Molecular Mass | 486.605 g·mol−1 |
| Heat of Formation | -233.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.43 ± 1.08 D |
| Volume | 625.38 Å 3 |
| Surface Area | 493.55 Å 2 |
| HOMO Energy | -9.33 ± 0.55 eV |
| LUMO Energy | 0.01 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | DOJSRSYBMNHTER-QORCZRPOSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |