3-{[3-(5,9-Dimethyl-4-Oxo-2-Phenyl-8-Oxatetracyclo[7.2.1.1~7,10~.0~1,6~]Tridec-5-Yl)Propanoyl]Amino}-2,4-Dihydroxybenzoic Acid
Properties
Property | Value |
---|---|
Formula | C30H33NO7 |
IUPAC Name | 3-{[3-(5,9-dimethyl-4-oxo-2-phenyl-8-oxatetracyclo[7.2.1.1 7,10 .0 1,6 ]tridec-5-yl)propanoyl]amino}-2,4-dihydroxybenzoic acid |
Molecular Mass | 519.586 g·mol−1 |
Heat of Formation | -1150.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.41 ± 1.08 D |
Volume | 598.35 Å 3 |
Surface Area | 477.27 Å 2 |
HOMO Energy | -9.09 ± 0.55 eV |
LUMO Energy | 2.32 ± eV |
Point Group Symmetry | C1 |
InChIKey | WDRJLSQVOAFEDA-ZORPPZNDSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |