(1S,2S,5R)-5-(6-Amino-9H-Purin-9-Yl)-3-Cyclopentene-1,2-Diol

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Properties Simple | Detailed

Formula C10H11N5O2
IUPAC Name (1s,2s,5r)-5-(6-amino-8h-purin-9-ium-8-ylium-9-yl)cyclopent-3-ene-1,2-diol
Molecular Mass 233.227 g·mol−1
Heat of Formation -10.5 ± 16.7 kJ·mol−1
Dipole Moment 3.46 ± 1.08 D
Volume 258.54 Å 3
Surface Area 240.04 Å 2
HOMO Energy -8.94 ± 0.55 eV
LUMO Energy 2.60 ± eV
Point Group Symmetry C1
Synonyms
  • (1'r,2's)-9-(2-hydroxy-3'-keto-cyclopenten-1-yl)adenine
  • (1s,2s,5r)-5-(6-amino-9-purinyl)cyclopent-3-ene-1,2-diol
InChIKey RQPALADHFYHEHK-CHKWXVPMSA-N
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