2'-O-(2-Aminobenzoyl)Adenosine 5'-(Dihydrogen Phosphate)

Molecule SVG Image

Properties Simple | Detailed

Formula C17H19N6O8P
IUPAC Name [(2r,3r,4r,5r)-2-(6-aminopurine-1,3,7-triium-9-yl)-4-hydroxy-5-(phosphonooxymethyl)tetrahydrofuran-3-yl] 2-aminobenzoate
Molecular Mass 466.342 g·mol−1
Heat of Formation -1360.5 ± 16.7 kJ·mol−1
Dipole Moment 6.02 ± 1.08 D
Volume 485.01 Å 3
Surface Area 420.73 Å 2
HOMO Energy -8.92 ± 0.55 eV
LUMO Energy -0.67 ± eV
Point Group Symmetry C1
InChIKey SVECXPKOHPSQAS-YGSHXTJESA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements P C H O N