3-[2-[[3-(2-Carboxyethyl)-5-[(Z)-(3-Ethyl-4-Methyl-5-Oxo-Pyrrolidin-2-Ylidene)Methyl]-4-Methyl-1H-Pyrrol-2-Yl]Methyl]-4-Methyl-5-[(3-Methyl-5-Oxo-4-Vinyl-Pyrrol-2-Yl)Methyl]-1H-Pyrrol-3-Yl]Propanoic Acid
Properties
| Property | Value |
|---|---|
| Formula | C33H40N4O6 |
| IUPAC Name | 3-[2-[[3-(2-carboxyethyl)-5-[(z)-[(3r,4r)-3-ethyl-4-methyl-5-oxo-pyrrolidin-2-ylidene]methyl]-4-methyl-pyrrol-1-ium-3-id-2-yl]methyl]-4-methyl-5-[(3-methyl-5-oxo-4-vinyl-pyrrol-2-yl)methyl]pyrrol-1-ium-5-ylium-3,4-diid-3-yl]propanoic acid |
| Molecular Mass | 588.694 g·mol−1 |
| Heat of Formation | -942.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.70 ± 1.08 D |
| Volume | 726.4 Å 3 |
| Surface Area | 582.39 Å 2 |
| HOMO Energy | -7.72 ± 0.55 eV |
| LUMO Energy | -1.35 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | OTCFLTZTYFVISX-GBQRZCIWSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |