Caiophoraenin
Properties
Property | Value |
---|---|
Formula | C11H18O5 |
IUPAC Name | (1s,4r,4as,5s,7s,7as)-5-hydroxy-7-(hydroxymethyl)-1-methoxy-4-methyl-4,4a,5,6,7,7a-hexahydro-1h-cyclopenta[c]pyran-3-one |
Molecular Mass | 230.258 g·mol−1 |
Heat of Formation | -953.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.86 ± 1.08 D |
Volume | 273.39 Å 3 |
Surface Area | 242.09 Å 2 |
HOMO Energy | -10.46 ± 0.55 eV |
LUMO Energy | 0.53 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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InChIKey | ZVEZLXLQLYOFMK-DRZZNBKRSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |