2-{(1E,3E,5E,7E)-7-[3,3-Dimethyl-5-Sulfonato-1-(2-Sulfonatoethyl)-1,3-Dihydro-2H-Indol-2-Ylidene]-4-Methyl-1,3,5-Heptatrien-1-Yl}-3,3-Dimethyl-1-(2-Sulfonatoethyl)-3H-Indolium-5-Sulfonate
Properties
| Property | Value |
|---|---|
| Formula | C32H35N2O12S4--- |
| IUPAC Name | (2e)-2-[(2e,4e,6e)-7-[3,3-dimethyl-5-sulfonato-1-(2-sulfonatoethyl)indol-1-ium-2-yl]-4-methylhepta-2,4,6-trienylidene]-3,3-dimethyl-1-(2-sulfonatoethyl)indole-5-sulfonate |
| Molecular Mass | 767.887 g·mol−1 |
| Heat of Formation | 1870.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 41.72 ± 1.08 D |
| Volume | 735.97 Å 3 |
| Surface Area | 630.36 Å 2 |
| HOMO Energy | -8.21 ± 0.55 eV |
| LUMO Energy | -3.65 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | WKWHOLCUESSZIQ-UHFFFAOYSA-K |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C S O N |