(1Ar,3As,5Ar,10As,10Br)-1A-[(2R)-1-Hydroxy-2-Propanyl]-3A,5A-Dimethyl-6-Oxo-2,3,3A,4,5,5A,6,7,10,10A-Decahydro-1Ah-Cyclohepta[6,7]Indeno[1,7A-B]Oxirene-8-Carbaldehyde
Properties
Property | Value |
---|---|
Formula | C20H28O4 |
IUPAC Name | (1ar,3as,5ar,10as,10br)-1a-[(2r)-1-hydroxy-2-propanyl]-3a,5a-dimethyl-6-oxo-2,3,3a,4,5,5a,6,7,10,10a-decahydro-1ah-cyclohepta[6,7]indeno[1,7a-b]oxirene-8-carbaldehyde |
Molecular Mass | 332.434 g·mol−1 |
Heat of Formation | -643.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.15 ± 1.08 D |
Volume | 412.99 Å 3 |
Surface Area | 319.86 Å 2 |
HOMO Energy | -9.80 ± 0.55 eV |
LUMO Energy | -0.43 ± eV |
Point Group Symmetry | C1 |
InChIKey | BEDOXLKSBWDRGE-QQQBWXDASA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |