(1S,2S)-2-Ethyl-1-({[(3As,4S,6R,7As)-6-Ethyl-1-Oxooctahydro-1H-Inden-4-Yl]Carbonyl}Amino)Cyclopropanecarboxylic Acid
Properties
| Property | Value |
|---|---|
| Formula | C18H27NO4 |
| IUPAC Name | (1s,2s)-1-[[(3as,4s,6r,7as)-6-ethyl-1-oxo-2,3,3a,4,5,6,7,7a-octahydroindene-4-carbonyl]amino]-2-ethyl-cyclopropanecarboxylic acid |
| Molecular Mass | 321.411 g·mol−1 |
| Heat of Formation | -802.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.66 ± 1.08 D |
| Volume | 404.1 Å 3 |
| Surface Area | 334.56 Å 2 |
| HOMO Energy | -9.87 ± 0.55 eV |
| LUMO Energy | 3.50 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | YYTFHRRGIDEJIS-FNEQEMTHSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |