1,3-Dimethyl-7-[(5-Methyl-1,2,4-Oxadiazol-3-Yl)Methyl]-3,7-Dihydro-1H-Purine-2,6-Dione
Properties
Property | Value |
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Formula | C11H12N6O3 |
IUPAC Name | 1,3-dimethyl-7-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]purine-2,6-dione |
Molecular Mass | 276.251 g·mol−1 |
Heat of Formation | -89.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.46 ± 1.08 D |
Volume | 301.3 Å 3 |
Surface Area | 280.67 Å 2 |
HOMO Energy | -8.97 ± 0.55 eV |
LUMO Energy | 2.15 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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CAS Number(s) |
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InChIKey | JBXSBZBZASARMY-UHFFFAOYSA-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 |