6-(Methylsulfanyl)-9-(5-O-Phosphono-β-D-Ribofuranosyl)-9H-Purine

Molecule SVG Image

Properties Simple | Detailed

Formula C11H15N4O7PS
IUPAC Name [(2r,3s,4r,5r)-3,4-dihydroxy-5-(6-methylsulfanylpurin-9-yl)tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 378.298 g·mol−1
Heat of Formation -1288.4 ± 16.7 kJ·mol−1
Dipole Moment 4.18 ± 1.08 D
Volume 383.61 Å 3
Surface Area 331.52 Å 2
HOMO Energy -8.57 ± 0.55 eV
LUMO Energy 2.06 ± eV
Point Group Symmetry C1
InChIKey BMYFUCYXRGTQQL-RYVZHVEOSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements C H O N P S