5C-Aglycone
Properties
Property | Value |
---|---|
Formula | C16H16O4 |
IUPAC Name | (2s)-2-methyl-4-(3-methyl-1,4-dioxo-2-naphthyl)butanoic acid |
Molecular Mass | 272.296 g·mol−1 |
Heat of Formation | -161.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.10 ± 1.08 D |
Volume | 332.13 Å 3 |
Surface Area | 285.79 Å 2 |
HOMO Energy | -8.87 ± 0.55 eV |
LUMO Energy | -0.74 ± eV |
Point Group Symmetry | C1 |
InChIKey | ALLYVKRLOHDVKI-SECBINFHSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |