| Formula |
C26H22ClN3O2S |
| IUPAC Name |
2-[1-[(5-chloro-2-methyl-benzothiophen-3-yl)methyl]-6-(3,5-diaminophenyl)indol-1-ium-3a-id-3-yl]acetic acid |
| Molecular Mass |
475.990 g·mol−1 |
| Heat of Formation |
-69.2 ± 16.7 kJ·mol−1 |
| Dipole Moment |
5.21 ± 1.08 D |
| Volume |
542.4 Å 3 |
| Surface Area |
457.02 Å 2 |
| HOMO Energy |
-8.26 ± 0.55 eV |
| LUMO Energy |
2.11 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
PFDAXQGFXBAMGF-UHFFFAOYSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
ChemSpider
|
| DOI |
|
| Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
| Elements |
C
Cl
H
O
N
S
|
| |
|
