[(2R,3S,4R,5R)-5-(7-Amino-2H-Imidazo[4,5-B]Pyridin-3-Ium-2-Ylium-3-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl Dihydrogen Phosphate

Molecule SVG Image

Properties Simple | Detailed

Formula C11H15N4O7P
IUPAC Name [(2r,3s,4r,5r)-5-(7-aminoimidazo[4,5-b]pyridine-1,4-diium-3-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 346.233 g·mol−1
Heat of Formation -1337.0 ± 16.7 kJ·mol−1
Dipole Moment 4.89 ± 1.08 D
Volume 355.51 Å 3
Surface Area 311.85 Å 2
HOMO Energy -8.71 ± 0.55 eV
LUMO Energy 2.77 ± eV
Point Group Symmetry C1
InChIKey MKNCBTMEOTYSIQ-PNHWDRBUSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements P C H O N