[(1S)-1-[(2,6-Diaminopurine-1,3,7-Triium-9-Yl)Methyl]-2-Hydroxy-Ethoxy]Methylphosphonic Acid
Properties
Property | Value |
---|---|
Formula | C9H15N6O5P |
IUPAC Name | [(1s)-1-[(2,6-diaminopurine-1,3,7-triium-9-yl)methyl]-2-hydroxy-ethoxy]methylphosphonic acid |
Molecular Mass | 318.226 g·mol−1 |
Heat of Formation | -944.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.54 ± 1.08 D |
Volume | 337.73 Å 3 |
Surface Area | 285.09 Å 2 |
HOMO Energy | -8.65 ± 0.55 eV |
LUMO Energy | -0.20 ± eV |
Point Group Symmetry | C1 |
InChIKey | UJWTXTBOTNOFSM-YFKPBYRVSA-O |
QR Code | Generate QR Code |
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Elements | P C H O N |