N-[3-[(4-Amino-1-Isopropyl-Pyrazolo[3,4-D]Pyrimidine-5,7-Diium-3A-Id-3-Yl)Methyl]Phenyl]Ethanesulfonamide
Properties
| Property | Value |
|---|---|
| Formula | C17H22N6O2S |
| IUPAC Name | n-[3-[(4-amino-1-isopropyl-pyrazolo[3,4-d]pyrimidine-5,7-diium-3a-id-3-yl)methyl]phenyl]ethanesulfonamide |
| Molecular Mass | 374.461 g·mol−1 |
| Heat of Formation | -54.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.01 ± 1.08 D |
| Volume | 437.76 Å 3 |
| Surface Area | 376.06 Å 2 |
| HOMO Energy | -8.80 ± 0.55 eV |
| LUMO Energy | -0.30 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | SQRIEKBOEZMMFU-UHFFFAOYSA-O |
| QR Code | Generate QR Code |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C S O N |