(5E)-5-[(2E)-4,7-Dihydroxy-2-Hepten-1-Ylidene]-4-Hydroxy-2-(Methylsulfanyl)-4-(4-Phenoxybutyl)-2-Cyclopenten-1-One
Properties
Property | Value |
---|---|
Formula | C23H30O5S |
IUPAC Name | (4r,5e)-5-[(e,4s)-4,7-dihydroxyhept-2-enylidene]-4-hydroxy-2-methylsulfanyl-4-(4-phenoxybutyl)cyclopent-2-en-1-one |
Molecular Mass | 418.546 g·mol−1 |
Heat of Formation | -729.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.81 ± 1.08 D |
Volume | 529.22 Å 3 |
Surface Area | 380.62 Å 2 |
HOMO Energy | -8.33 ± 0.55 eV |
LUMO Energy | -0.93 ± eV |
Point Group Symmetry | C1 |
InChIKey | TTYCPWCOWCUKKS-FRRLKSHYSA-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 |