(3R,3Ar,6As)-3-Isopropyl-1-(Methylsulfonyl)-4-{[2-(1-Pyrrolidinylmethyl)-1,3-Oxazol-4-Yl]Carbonyl}Hexahydropyrrolo[3,2-B]Pyrrol-2(1H)-One
Properties
| Property | Value |
|---|---|
| Formula | C19H28N4O5S |
| IUPAC Name | (3as,6r,6ar)-6-isopropyl-4-methylsulfonyl-1-[2-(pyrrolidin-1-ylmethyl)oxazole-4-carbonyl]-3,3a,6,6a-tetrahydro-2h-pyrrolo[3,2-b]pyrrol-5-one |
| Molecular Mass | 424.514 g·mol−1 |
| Heat of Formation | -695.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.33 ± 1.08 D |
| Volume | 487.36 Å 3 |
| Surface Area | 410.89 Å 2 |
| HOMO Energy | -9.38 ± 0.55 eV |
| LUMO Energy | -0.68 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | MEDXAFZZWXHGBT-UAGQMJEPSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H S C O N |