[[(2R,3S,4R,5R)-5-(2-Amino-6,8-Dioxo-1,7-Dihydropurin-3-Ium-5-Id-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-Phosphoryl] Phosphono Hydrogen Phosphate

Molecule SVG Image

Properties Simple | Detailed

Formula C10H17N5O15P3
IUPAC Name [[(2r,3s,4r,5r)-5-(2-amino-6,8-dioxo-1,7-dihydropurin-3-ium-5-id-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate
Molecular Mass 540.188 g·mol−1
Heat of Formation -3510.3 ± 16.7 kJ·mol−1
Dipole Moment 7.57 ± 1.08 D
Volume 496.11 Å 3
Surface Area 405.85 Å 2
HOMO Energy -8.86 ± 0.55 eV
LUMO Energy -1.49 ± eV
Point Group Symmetry C1
InChIKey WOYSDBLBNLLBDX-XUHIHXAHSA-P
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements P C H O N