1-Butyl-3-Propyl-3,4,5,7-Tetrahydro-1H-Purine-2,6-Dione
Properties
Property | Value |
---|---|
Formula | C12H20N4O2 |
IUPAC Name | 1-butyl-3-propyl-5,9-dihydro-4h-purine-2,6-dione |
Molecular Mass | 252.313 g·mol−1 |
Heat of Formation | -334.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 1.79 ± 1.08 D |
Volume | 314.68 Å 3 |
Surface Area | 287.77 Å 2 |
HOMO Energy | -9.73 ± 0.55 eV |
LUMO Energy | 0.04 ± eV |
Point Group Symmetry | C1 |
InChIKey | AGPCTXLRRJTGBX-NXEZZACHSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |