[(2R,3S,4R,5R)-5-(2-Amino-1-Methyl-6-Thioxo-Purine-1,9-Diium-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl Dihydrogen Phosphate
Properties
Property | Value |
---|---|
Formula | C11H18N5O7PS+ |
IUPAC Name | [(2r,3s,4r,5r)-5-(2-amino-1-methyl-6-thioxo-purine-1,9-diium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate |
Molecular Mass | 395.329 g·mol−1 |
Heat of Formation | -1232.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 9.07 ± 1.08 D |
Volume | 400.94 Å 3 |
Surface Area | 347.61 Å 2 |
HOMO Energy | -8.25 ± 0.55 eV |
LUMO Energy | 2.13 ± eV |
Point Group Symmetry | C1 |
InChIKey | VOJHOSVMBABLJK-FJGDRVTGSA-P |
QR Code | Generate QR Code |
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Elements | C H O N P S |