(4R,4Ar,6As,7R,10Ar,11As,11Br)-10A-Hydroxy-4,7,11B-Trimethyl-9-Oxo-1,2,3,4,4A,5,6,6A,7,9,10A,11,11A,11B-Tetradecahydrophenanthro[3,2-B]Furan-4-Carboxylic Acid
Properties
Property | Value |
---|---|
Formula | C20H28O5 |
IUPAC Name | (4r,4ar,6as,7r,10ar,11as,11br)-10a-hydroxy-4,7,11b-trimethyl-9-oxo-1,2,3,4a,5,6,6a,7,11,11a-decahydronaphtho[2,1-f]benzofuran-4-carboxylic acid |
Molecular Mass | 348.433 g·mol−1 |
Heat of Formation | -1016.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.16 ± 1.08 D |
Volume | 416.06 Å 3 |
Surface Area | 327.06 Å 2 |
HOMO Energy | -10.45 ± 0.55 eV |
LUMO Energy | -0.54 ± eV |
Point Group Symmetry | C1 |
InChIKey | YWQJKAJFLCNHPB-LXTJJRHQSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |