[[[(2R,3S,4R,5R)-5-(2-Amino-6-Oxo-3H-Purine-1,7-Diium-4-Id-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-Phosphoryl]Oxy-Hydroxy-Phosphoryl]Oxy-Fluoro-Phosphinic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C10H16FN5O13P3
IUPAC Name [[[(2r,3s,4r,5r)-5-(2-amino-6-oxo-3h-purine-1,7-diium-4-id-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxy-fluoro-phosphinic acid
Molecular Mass 526.179 g·mol−1
Heat of Formation -3318.1 ± 16.7 kJ·mol−1
Dipole Moment 9.54 ± 1.08 D
Volume 476.0 Å 3
Surface Area 361.06 Å 2
HOMO Energy -8.96 ± 0.55 eV
LUMO Energy -1.66 ± eV
Point Group Symmetry C1
InChIKey MXVUCWKXZCLCCR-UUOKFMHZSA-P
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements C F H O N P