N-(4-Butylphenyl)-2'-Deoxyguanosine 5'-(Tetrahydrogen Triphosphate)

Molecule SVG Image

Properties Simple | Detailed

Formula C20H29N5O13P3
IUPAC Name [[(2r,3s,5r)-5-[2-(4-butylanilino)-6-oxo-3h-purine-1,7-diium-4-id-9-yl]-3-hydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate
Molecular Mass 640.391 g·mol−1
Heat of Formation -3032.4 ± 16.7 kJ·mol−1
Dipole Moment 11.51 ± 1.08 D
Volume 652.51 Å 3
Surface Area 500.45 Å 2
HOMO Energy -9.04 ± 0.55 eV
LUMO Energy -1.51 ± eV
Point Group Symmetry C1
InChIKey JLKDXNDMDDENMB-PMPSAXMXSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements P C H O N