(5α)-17-Allyl-14-Hydroxy-6-Oxo-4,5-Epoxymorphinan-3-Yl Hydrogen Sulfate
Properties
Property | Value |
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Formula | C19H21NO7S |
IUPAC Name | [(3r,4r,4as,7ar,12bs)-3-allyl-4a-hydroxy-7-oxo-2,4,5,6,7a,13-hexahydro-1h-4,12-methanobenzofuro[3,2-e]isoquinoline-9-yl] hydrogen sulfate |
Molecular Mass | 407.438 g·mol−1 |
Heat of Formation | -985.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.76 ± 1.08 D |
Volume | 439.45 Å 3 |
Surface Area | 350.8 Å 2 |
HOMO Energy | -9.02 ± 0.55 eV |
LUMO Energy | -0.53 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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CAS Number(s) |
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InChIKey | PAJPQFFSQUPZNW-GRGSLBFTSA-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 |