2,6-Dioxo-2,3,6,7-Tetrahydro-1H-Purin-8-Yl 3-(3H-Indol-3-Yl)Alaninate
Properties
| Property | Value |
|---|---|
| Formula | C16H14N6O4 |
| IUPAC Name | 2-[9-[(4z,6z,8z)-2,3-dihydro-1h-azonine-3-carbonyl]-2,6-dioxo-purine-1,3,7-triium-8-yl]oxyacetonitrile |
| Molecular Mass | 354.320 g·mol−1 |
| Heat of Formation | 1915.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 21.33 ± 1.08 D |
| Volume | 358.18 Å 3 |
| Surface Area | 326.1 Å 2 |
| HOMO Energy | -9.27 ± 0.55 eV |
| LUMO Energy | -4.74 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | XJRPGCBTEMRPMB-IONNQARKSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C O N |