(3Ar,5As,8S,10As)-1-({(3S,6R,8As)-1'-[(2S)-2-Acetamido-3-(2-Chlorophenyl)Propanoyl]-5-Oxo-1,2,3,8A-Tetrahydrospiro[Indolizine-6,2'-Pyrrolidin]-3-Yl}Carbonyl)-10-Oxo-1,2,3,3A,5A,8,10,10A-Octahydrodipyr Rolo[1,2-A:3',2'-E]Azepine-8-Carboxylic Acid (Non-Preferred Name)
Properties
| Property | Value |
|---|---|
| Formula | C35H38ClN5O7 |
| IUPAC Name | (3ar,5as,8s,10as)-1-[(3s,6r,8as)-1'-[(2s)-2-acetamido-3-(2-chlorophenyl)propanoyl]-5-oxo-spiro[1,2,3,8a-tetrahydroindolizine-6,2'-pyrrolidine]-3-carbonyl]-10-oxo-2,3,3a,5a,8,10a-hexahydrodipyrrolo[3,2-b:1',3'-e]azepine-8-carboxylic acid |
| Molecular Mass | 676.159 g·mol−1 |
| Heat of Formation | -961.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.89 ± 1.08 D |
| Volume | 761.11 Å 3 |
| Surface Area | 581.92 Å 2 |
| HOMO Energy | -9.03 ± 0.55 eV |
| LUMO Energy | 2.96 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | PORJLWGURWUCLW-QHVDBZGRSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C N O Cl |