(12S)-12-[(1R)-2-{[(4S)-6-Ethyl-3,4-Dihydrospiro[Chromene-2,1'-Cyclobutan]-4-Yl]Amino}-1-Hydroxyethyl]-1,13-Diazatricyclo[13.3.1.1~6,10~]Icosa-6(20),7,9,15(19),16-Pentaene-14,18-Dione
Properties
| Property | Value |
|---|---|
| Formula | C34H41N3O4 |
| IUPAC Name | (12s)-12-[(1r)-2-[[(4s)-6-ethylspiro[chromane-2,1'-cyclobutane]-4-yl]amino]-1-hydroxy-ethyl]-1,13-diazatricyclo[13.3.1.16,10]icosa-6(20),7,9,15(19),16-pentaene-14,18-dione |
| Molecular Mass | 555.707 g·mol−1 |
| Heat of Formation | -549.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.38 ± 1.08 D |
| Volume | 691.69 Å 3 |
| Surface Area | 553.86 Å 2 |
| HOMO Energy | -8.59 ± 0.55 eV |
| LUMO Energy | -0.69 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | LCSGKLXXIKDHLA-OIFRRMEBSA-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 |