Sodwanone S
Properties
Property | Value |
---|---|
Formula | C30H50O5 |
IUPAC Name | (5as,6s,7s,9as)-6-[2-[(3s,6s,7s,9as)-3-hydroxy-2,2,6,7-tetramethyl-3,4,7,8,9,9a-hexahydro-1-benzoxepin-6-yl]ethyl]-7-hydroxy-2,2,5a,7-tetramethyl-4,5,6,8,9,9a-hexahydrobenzo[b]oxepin-3-one |
Molecular Mass | 490.715 g·mol−1 |
Heat of Formation | -1204.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.73 ± 1.08 D |
Volume | 641.14 Å 3 |
Surface Area | 466.45 Å 2 |
HOMO Energy | -9.24 ± 0.55 eV |
LUMO Energy | 3.78 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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InChIKey | KKTMKQNIICOHDR-UDZSLJHISA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |