(3E,5S)-3-[[(1R,2R,4As,8Ar)-2-Methyl-1,2,4A,5,6,7,8,8A-Octahydronaphthalen-1-Yl]-Hydroxy-Methylene]-5-[(1R)-1-Hydroxyethyl]-1-Methyl-Pyrrolidine-2,4-Dione
Properties
| Property | Value |
|---|---|
| Formula | C19H27NO4 |
| IUPAC Name | (3e,5s)-3-[[(1r,2r,4as,8ar)-2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl]-hydroxy-methylene]-5-[(1r)-1-hydroxyethyl]-1-methyl-pyrrolidine-2,4-dione |
| Molecular Mass | 333.422 g·mol−1 |
| Heat of Formation | -787.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 1.67 ± 1.08 D |
| Volume | 409.64 Å 3 |
| Surface Area | 334.32 Å 2 |
| HOMO Energy | -9.46 ± 0.55 eV |
| LUMO Energy | -0.64 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | ACUUAFHILDALFB-WNIYYJJJSA-N |
| QR Code | Generate QR Code |
| Links | PubChem |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |