(5As,6S)-5A-Methyl-5,5A,6,7,10,11-Hexahydro-4H-[1]Benzothieno[4,5-H]Isothiochromen-6-Ol
Properties
Property | Value |
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Formula | C16H18OS2 |
IUPAC Name | (5as,6s)-5a-methyl-4,5,6,7,10,11-hexahydrobenzothiopheno[4,5-h]isothiochromen-6-ol |
Molecular Mass | 290.444 g·mol−1 |
Heat of Formation | -53.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.24 ± 1.08 D |
Volume | 337.65 Å 3 |
Surface Area | 281.97 Å 2 |
HOMO Energy | -7.94 ± 0.55 eV |
LUMO Energy | -0.58 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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CAS Number(s) |
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InChIKey | SCBZANADWSAVET-CVEARBPZSA-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 |