[(2R,3S,4R,5R)-5-[4-Amino-3-(1-Aza-3-Azonia-2-Azanidacyclopenta-3,5-Dien-4-Yl)Pyrazolo[3,4-D]Pyrimidin-1-Ium-3A,4,7-Triid-1-Yl]-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl Dihydrogen Phosphate
Properties
Property | Value |
---|---|
Formula | C12H17N8O7P |
IUPAC Name | [(2r,3s,4r,5r)-5-[4-amino-3-(1-aza-3-azonia-2-azanidacyclopenta-3,5-dien-4-yl)pyrazolo[3,4-d]pyrimidin-1-ium-3a,4,7-triid-1-yl]-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate |
Molecular Mass | 416.286 g·mol−1 |
Heat of Formation | -1016.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.43 ± 1.08 D |
Volume | 419.72 Å 3 |
Surface Area | 356.78 Å 2 |
HOMO Energy | -9.56 ± 0.55 eV |
LUMO Energy | -1.46 ± eV |
Point Group Symmetry | C1 |
InChIKey | NWFXOSLOHWUXDG-JJNLEZRASA-O |
QR Code | Generate QR Code |
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Elements | P C H O N |