6-[(1E,3E,5E,7E)-8-(3-Chloro-1H-Pyrrol-2-Yl)-1,3,5,7-Octatetraen-1-Yl]-4-Methoxy-3-Methyl-2H-Pyran-2-One
Properties
| Property | Value |
|---|---|
| Formula | C19H18ClNO3 |
| IUPAC Name | 6-[(1e,3e,5e,7e)-8-(3-chloropyrrol-1-ium-2-ylium-2-yl)octa-1,3,5,7-tetraenyl]-4-methoxy-3-methyl-pyran-2-one |
| Molecular Mass | 343.804 g·mol−1 |
| Heat of Formation | -135.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.44 ± 1.08 D |
| Volume | 407.75 Å 3 |
| Surface Area | 388.63 Å 2 |
| HOMO Energy | -8.54 ± 0.55 eV |
| LUMO Energy | -1.48 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | PVDBICYNLATHGO-MIIZMDLZSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C N O Cl |