2-Amino-7-[2-[[2-Hydroxy-1-(Hydroxymethyl)Ethyl]Amino]Ethyl]-1H-Purine-3,9-Diium-5-Id-6-One
Properties
Property | Value |
---|---|
Formula | C10H18N6O3 |
IUPAC Name | 2-amino-7-[2-[[2-hydroxy-1-(hydroxymethyl)ethyl]amino]ethyl]-1h-purine-3,9-diium-5-id-6-one |
Molecular Mass | 270.288 g·mol−1 |
Heat of Formation | -306.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.72 ± 1.08 D |
Volume | 309.23 Å 3 |
Surface Area | 285.4 Å 2 |
HOMO Energy | -9.05 ± 0.55 eV |
LUMO Energy | -0.66 ± eV |
Point Group Symmetry | C1 |
InChIKey | PRYCHWXXRADIMF-UHFFFAOYSA-O |
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Elements | H C O N |