[(2R,5R)-5-[6-Amino-8-(Dimethylamino)Purine-1,3,7-Triium-9-Yl]-3-Hydroxy-2,5-Dihydrofuran-2-Yl]Methyl Dihydrogen Phosphate
Properties
Property | Value |
---|---|
Formula | C12H17N6O6P |
IUPAC Name | [(2r,5r)-5-[6-amino-8-(dimethylamino)purine-1,3,7-triium-9-yl]-3-hydroxy-2,5-dihydrofuran-2-yl]methyl dihydrogen phosphate |
Molecular Mass | 372.274 g·mol−1 |
Heat of Formation | -1038.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.76 ± 1.08 D |
Volume | 390.67 Å 3 |
Surface Area | 330.21 Å 2 |
HOMO Energy | -8.76 ± 0.55 eV |
LUMO Energy | -0.72 ± eV |
Point Group Symmetry | C1 |
InChIKey | NUPLXGSOECPBAW-HTQZYQBOSA-O |
QR Code | Generate QR Code |
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Elements | P C H O N |