1-[(6R,7R)-6-Hydroxy-5,5-Dimethyl-2-Nitro-6,7-Dihydro-5H-Thieno[3,2-B]Pyran-7-Yl]-2-Piperidinone
Properties
Property | Value |
---|---|
Formula | C14H18N2O5S |
IUPAC Name | 1-[(6r,7r)-6-hydroxy-5,5-dimethyl-2-nitro-6,7-dihydrothieno[3,2-b]pyran-7-yl]piperidin-2-one |
Molecular Mass | 326.368 g·mol−1 |
Heat of Formation | -503.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 8.87 ± 1.08 D |
Volume | 359.71 Å 3 |
Surface Area | 299.68 Å 2 |
HOMO Energy | -8.87 ± 0.55 eV |
LUMO Energy | -1.38 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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InChIKey | QPFLGGHDOFTBOK-WCQYABFASA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C S O N |