Methyl 4-Amino-7-(β-D-Ribofuranosyl)-7H-Pyrrolo[2,3-D]Pyrimidine-5-Carboxylate

Molecule SVG Image

Properties Simple | Detailed

Formula C13H16N4O6
IUPAC Name methyl 4-amino-7-[(2s,3s,4s,5s)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrrolo[2,3-d]pyrimidin-7-ium-5-carboxylate
Molecular Mass 324.289 g·mol−1
Heat of Formation -878.0 ± 16.7 kJ·mol−1
Dipole Moment 4.91 ± 1.08 D
Volume 344.33 Å 3
Surface Area 306.51 Å 2
HOMO Energy -8.76 ± 0.55 eV
LUMO Energy -0.60 ± eV
Point Group Symmetry C1
InChIKey CEZTWGUUIVXSPB-CIPNSKCISA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N