4-Amino-1-(5-O-Phosphono-β-D-Ribofuranosyl)-2(1H)-Pyrimidinethione
Properties
Property | Value |
---|---|
Formula | C9H14N3O7PS |
IUPAC Name | [(2r,3s,4r,5r)-5-(4-amino-2-thioxo-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate |
Molecular Mass | 339.262 g·mol−1 |
Heat of Formation | -1393.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.86 ± 1.08 D |
Volume | 346.13 Å 3 |
Surface Area | 308.07 Å 2 |
HOMO Energy | -8.46 ± 0.55 eV |
LUMO Energy | 2.06 ± eV |
Point Group Symmetry | C1 |
InChIKey | BPWVHBCPZTVLLY-ZAKLUEHWSA-O |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
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Elements | C H O N P S |