3-[2-[[3-(2-Carboxyethyl)-4-Methyl-5-[(4-Methyl-5-Oxo-3-Vinyl-Pyrrol-2-Ylidene)Methyl]-1H-Pyrrol-2-Yl]Methylene]-4-Methyl-5-[(3-Methyl-5-Oxo-4-Vinyl-Pyrrol-1-Ium-2-Yl)Methylene]Pyrrol-3-Yl]Propanoic Acid
Properties
| Property | Value |
|---|---|
| Formula | C33H34N4O6 |
| IUPAC Name | acetic acid; (1e,3e,5z,8e)-8-ethyl-2-methyl-7-methylene-10-[4-methyl-5-[(3-methyl-5-oxo-4-vinyl-pyrrol-1-ium-2-yl)methyl]-3h-pyrrol-3-id-2-yl]-3-vinyl-deca-1,3,5,8-tetraen-1-olate; hydron; hydroxymethanone; λ1-azane; λ2-carbane |
| Molecular Mass | 582.646 g·mol−1 |
| Heat of Formation | 3764.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 20.74 ± 1.08 D |
| Volume | 618.41 Å 3 |
| Surface Area | 530.01 Å 2 |
| HOMO Energy | -9.24 ± 0.55 eV |
| LUMO Energy | -4.48 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | RCNSAJSGRJSBKK-BEDCZWNXSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C O N |