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 |