Morphinan-3-Ol, 6-(Acetylthio)-7,8-Didehydro-4,5-Epoxy-17-Methyl-, (5α,6Beta)-
Properties
Property | Value |
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Formula | C19H21NO3S |
IUPAC Name | s-[(4r,4ar,7r,7ar,12bs)-9-hydroxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1h-4,12-methanobenzofuro[3,2-e]isoquinolin-7-yl] ethanethioate |
Molecular Mass | 343.440 g·mol−1 |
Heat of Formation | -321.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.37 ± 1.08 D |
Volume | 389.52 Å 3 |
Surface Area | 320.87 Å 2 |
HOMO Energy | -8.49 ± 0.55 eV |
LUMO Energy | -0.57 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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CAS Number(s) |
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InChIKey | IQAOQEHSVLTFRY-MKUCUKIISA-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 |