N-(7-Benzyl-6-Oxo-3H-Purine-1,9-Diium-5-Id-2-Yl)Acetamide
Properties
Property | Value |
---|---|
Formula | C14H20N5O2+ |
IUPAC Name | n-(7-benzyl-6-oxo-3h-purine-1,9-diium-5-id-2-yl)acetamide |
Molecular Mass | 290.341 g·mol−1 |
Heat of Formation | 32.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.37 ± 1.08 D |
Volume | 322.42 Å 3 |
Surface Area | 296.81 Å 2 |
HOMO Energy | -9.03 ± 0.55 eV |
LUMO Energy | 2.66 ± eV |
Point Group Symmetry | C1 |
InChIKey | SUWHNLILVPYHNN-UHFFFAOYSA-O |
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Elements | H C O N |