3-(2-Deoxy-5-O-Phosphonopentofuranosyl)-4,6,7,8-Tetrahydropyrimido[1,2-A]Purin-10(3H)-One
Properties
Property | Value |
---|---|
Formula | C13H18N5O7P |
IUPAC Name | [(2s,3r,5s)-3-hydroxy-5-(10-oxo-4,6,7,8-tetrahydropyrimido[1,2-a]purin-3-yl)tetrahydrofuran-2-yl]methyl dihydrogen phosphate |
Molecular Mass | 387.285 g·mol−1 |
Heat of Formation | 771.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 13.54 ± 1.08 D |
Volume | 365.49 Å 3 |
Surface Area | 345.83 Å 2 |
HOMO Energy | -9.22 ± 0.55 eV |
LUMO Energy | -4.02 ± eV |
Point Group Symmetry | C1 |
InChIKey | KFIWNSGDRAITKG-DJLDLDEBSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
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Elements | P C O N |