3-Hydroxy-2,2-Dimethyl-4-[(3-Oxo-1-Cyclopenten-1-Yl)Oxy]-6-Chromanecarbonitrile
Properties
Property | Value |
---|---|
Formula | C17H17NO4 |
IUPAC Name | (3r,4r)-3-hydroxy-2,2-dimethyl-4-(3-oxocyclopenten-1-yl)oxy-chromane-6-carbonitrile |
Molecular Mass | 299.321 g·mol−1 |
Heat of Formation | -447.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 9.34 ± 1.08 D |
Volume | 352.87 Å 3 |
Surface Area | 311.83 Å 2 |
HOMO Energy | -9.68 ± 0.55 eV |
LUMO Energy | 2.07 ± eV |
Point Group Symmetry | C1 |
InChIKey | WJBHHTPFTVKZCV-HZPDHXFCSA-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 |