[(2R,3S,4R,5R)-5-[8-(6-Aminohexylamino)-6-Oxo-3H-Purine-1,7-Diium-4-Id-9-Yl]-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl Dihydrogen Phosphate

Molecule SVG Image

Properties Simple | Detailed

Formula C16H29N6O8P+
IUPAC Name [(2r,3s,4r,5r)-5-[8-(6-aminohexylamino)-6-oxo-3h-purine-1,7-diium-4-id-9-yl]-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 464.411 g·mol−1
Heat of Formation -1542.7 ± 16.7 kJ·mol−1
Dipole Moment 10.11 ± 1.08 D
Volume 511.08 Å 3
Surface Area 427.49 Å 2
HOMO Energy -8.81 ± 0.55 eV
LUMO Energy -0.84 ± eV
Point Group Symmetry C1
InChIKey PVXMWEJDXJQFLN-SDBHATRESA-P
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements P C H O N