(4'R,4A'S,7A'R,12B'S)-4A',9'-Dihydroxy-3'-Methyl-1,1',2',3,3',4',4A',5'-Octahydrospiro[Indene-2,6'-[4,12]Methano[1]Benzofuro[3,2-E]Isoquinolin]-7'(7A'H)-One
Properties
| Property | Value |
|---|---|
| Formula | C25H25NO4 |
| IUPAC Name | (3s,4r,4as,7ar,12bs)-4a,9-dihydroxy-3-methyl-spiro[1,2,4,5,7a,13-hexahydro-4,12-methanobenzofuro[3,2-e]isoquinoline-6,2'-indane]-7-one |
| Molecular Mass | 403.470 g·mol−1 |
| Heat of Formation | -446.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.20 ± 1.08 D |
| Volume | 457.76 Å 3 |
| Surface Area | 364.27 Å 2 |
| HOMO Energy | -8.62 ± 0.55 eV |
| LUMO Energy | -0.13 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | YJWDKWRVFJZBCJ-QVJDATKISA-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 |