(1R,2S,3R)-3-(4-Amino-1H-Imidazo[4,5-C]Pyridin-1-Yl)-1,2-Cyclopentanediol

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Properties Simple | Detailed

Formula C11H14N4O2
IUPAC Name (1r,2s,3r)-3-(4-aminoimidazo[4,5-c]pyridin-1-ium-1-yl)cyclopentane-1,2-diol
Molecular Mass 234.254 g·mol−1
Heat of Formation -166.0 ± 16.7 kJ·mol−1
Dipole Moment 6.32 ± 1.08 D
Volume 271.3 Å 3
Surface Area 247.65 Å 2
HOMO Energy -8.27 ± 0.55 eV
LUMO Energy -0.04 ± eV
Point Group Symmetry C1
Synonyms
  • (1r,2s,3r)-3-(4-amino-1-imidazo[4,5-c]pyridinyl)cyclopentane-1,2-diol
  • (1r,2s,3r)-3-(4-aminoimidazo[4,5-c]pyridin-1-yl)cyclopentane-1,2-diol
  • 1,2-cyclopentaediol, 3-(4-amino-1h-imidazo(4,5-c)pyridin-1-yl)-, (1r-(1alpha,2alpha,3beta))-
  • 1,2-cyclopentanediol, 3-(4-amino-1h-imidazo[4,5-c]pyridin-1-yl)-,[1r-(1.alpha.,2.alpha.,3.beta.)]-
  • 3-deaza-dhcaa
  • 9-(2',3'-dihydroxypentan-1'-yl)-3-deazaadenine
  • c^3dhcaa
CAS Number(s)
  • 149564-05-6
InChIKey RUCFKJGLNUIODR-MRTMQBJTSA-N
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