Bis[[(2R,3S,4R,5R)-5-(2-Amino-6-Oxo-1H-Purine-3,7-Diium-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-Phosphoryl] Hydrogen Phosphate

Molecule SVG Image

Properties Simple | Detailed

Formula C20H27N10O18P3
IUPAC Name bis[[(2r,3s,4r,5r)-5-(2-amino-6-oxo-1h-purine-3,7-diium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] hydrogen phosphate
Molecular Mass 788.406 g·mol−1
Heat of Formation -3701.1 ± 16.7 kJ·mol−1
Dipole Moment 6.85 ± 1.08 D
Volume 763.97 Å 3
Surface Area 605.74 Å 2
HOMO Energy -9.15 ± 0.55 eV
LUMO Energy -1.60 ± eV
Point Group Symmetry C1
InChIKey HLXRWLPPTIPXGS-MHARETSRSA-R
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements P C H O N