4-Amino-7-β-D-Ribofuranosyl-7H-Pyrrolo(2,3-D)Pyrimidine-5-Methanol

Molecule SVG Image

Properties Simple | Detailed

Formula C12H16N4O5
IUPAC Name (2s,3s,4s,5r)-2-[4-amino-5-(hydroxymethyl)pyrrolo[2,3-d]pyrimidin-7-ium-7-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
Molecular Mass 296.279 g·mol−1
Heat of Formation -734.7 ± 16.7 kJ·mol−1
Dipole Moment 3.10 ± 1.08 D
Volume 325.64 Å 3
Surface Area 289.33 Å 2
HOMO Energy -8.77 ± 0.55 eV
LUMO Energy -0.44 ± eV
Point Group Symmetry C1
InChIKey HVMYWBSUWVFUFB-WJOUQXRDSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N