Formula |
C28H20O12 |
IUPAC Name |
1-[2-[(4s)-5-carboxy-4-hydroxy-pentanoyl]-6-hydroxy-benzoyl]-3,8-dihydroxy-9,10-dioxo-anthracene-2-carboxylic acid |
Molecular Mass |
548.451 g·mol−1 |
Heat of Formation |
-1840.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.82 ± 1.08 D |
Volume |
571.15 Å 3 |
Surface Area |
447.92 Å 2 |
HOMO Energy |
-9.76 ± 0.55 eV |
LUMO Energy |
-2.21 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
XFESZXMDORIFAO-NSHDSACASA-N |
QR Code |
Generate QR Code |
Links |
PubChem
ChemSpider
|
DOI |
|
Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
Elements |
H
C
O
|
|
|