(2E,4E)-N-[3-(3-Amino-3-Oxopropyl)-3-Hydroxy-6-Oxo-1,4-Cyclohexadien-1-Yl]-6-Methyl-2,4-Heptadienamide
Properties
Property | Value |
---|---|
Formula | C17H22N2O4 |
IUPAC Name | (2e,4e)-n-[(3s)-3-(3-amino-3-oxo-propyl)-3-hydroxy-6-oxo-cyclohexa-1,4-dien-1-yl]-6-methyl-hepta-2,4-dienamide |
Molecular Mass | 318.368 g·mol−1 |
Heat of Formation | -563.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.95 ± 1.08 D |
Volume | 396.02 Å 3 |
Surface Area | 366.45 Å 2 |
HOMO Energy | -9.22 ± 0.55 eV |
LUMO Energy | -1.07 ± eV |
Point Group Symmetry | C1 |
InChIKey | ZQYBDDWUEWCXIM-KNOWPERHSA-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 |