[(2S,3S,4R,5R)-3-[[(2S)-2-Amino-3-Phenyl-Propanoyl]Amino]-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-4-Hydroxy-Tetrahydrofuran-2-Yl]Methyl Dihydrogen Phosphate

Molecule SVG Image

Properties Simple | Detailed

Formula C19H24N7O7P
IUPAC Name [(2s,3s,4r,5r)-3-[[(2s)-2-amino-3-phenyl-propanoyl]amino]-5-(6-aminopurine-1,3,7-triium-9-yl)-4-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 493.410 g·mol−1
Heat of Formation -1207.2 ± 16.7 kJ·mol−1
Dipole Moment 3.59 ± 1.08 D
Volume 543.44 Å 3
Surface Area 463.61 Å 2
HOMO Energy -9.19 ± 0.55 eV
LUMO Energy -0.64 ± eV
Point Group Symmetry C1
InChIKey RXMSSOHECUVGOO-YCOMJZELSA-O
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements P C H O N