4-[2-[[2-(Benzothiophen-3-Yl)-9-Isopropyl-Purine-1,3,7-Triium-6-Yl]Amino]Ethyl]Phenol
Properties
| Property | Value |
|---|---|
| Formula | C24H23N5OS |
| IUPAC Name | 4-[2-[[2-(benzothiophen-3-yl)-9-isopropyl-purine-1,3,7-triium-6-yl]amino]ethyl]phenol |
| Molecular Mass | 429.537 g·mol−1 |
| Heat of Formation | 272.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.03 ± 1.08 D |
| Volume | 511.57 Å 3 |
| Surface Area | 422.98 Å 2 |
| HOMO Energy | -8.39 ± 0.55 eV |
| LUMO Energy | 2.19 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | SXXHYCLLYYCLQD-UHFFFAOYSA-O |
| QR Code | Generate QR Code |
| Links | |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H S C O N |