(5R)-4-Hydroxy-5-Methyl-5-[(1E)-2-Methyl-1,3-Butadien-1-Yl]-3-Propyl-2(5H)-Thiophenone
Properties
Property | Value |
---|---|
Formula | C13H18O2S |
IUPAC Name | (5r)-4-hydroxy-5-methyl-5-[(1e)-2-methylbuta-1,3-dienyl]-3-propyl-thiophen-2-one |
Molecular Mass | 238.346 g·mol−1 |
Heat of Formation | -289.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.40 ± 1.08 D |
Volume | 304.9 Å 3 |
Surface Area | 272.37 Å 2 |
HOMO Energy | -9.07 ± 0.55 eV |
LUMO Energy | 2.51 ± eV |
Point Group Symmetry | C1 |
InChIKey | FWXFBNQENPGUSS-MMQHEFTJSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C S O |