2,8-Diamino-9-Benzyl-3H-Purine-1,7-Diium-4-Id-6-One
Properties
Property | Value |
---|---|
Formula | C12H14N6O+ |
IUPAC Name | 2,8-diamino-9-benzyl-3h-purine-1,7-diium-4-id-6-one |
Molecular Mass | 258.279 g·mol−1 |
Heat of Formation | 248.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 10.10 ± 1.08 D |
Volume | 292.31 Å 3 |
Surface Area | 266.98 Å 2 |
HOMO Energy | -8.91 ± 0.55 eV |
LUMO Energy | 2.52 ± eV |
Point Group Symmetry | C1 |
InChIKey | UACRSLVUZQQJQX-UHFFFAOYSA-P |
QR Code | Generate QR Code |
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Elements | H C O N |