9-(5-Chloro-5-Deoxy-β-D-Lyxofuranosyl)-9H-Purin-6-Amine

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Properties Simple | Detailed

Formula C10H12ClN5O3
IUPAC Name (2r,3s,4r,5s)-2-(6-aminopurin-9-yl)-5-(chloromethyl)tetrahydrofuran-3,4-diol
Molecular Mass 285.687 g·mol−1
Heat of Formation -343.7 ± 16.7 kJ·mol−1
Dipole Moment 1.65 ± 1.08 D
Volume 290.86 Å 3
Surface Area 247.14 Å 2
HOMO Energy -9.16 ± 0.55 eV
LUMO Energy -0.65 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3s,4r,5s)-2-(6-amino-9-purinyl)-5-(chloromethyl)tetrahydrofuran-3,4-diol
  • (2r,3s,4r,5s)-2-(6-aminopurin-9-yl)-5-(chloromethyl)tetrahydrofuran-3,4-diol
InChIKey IYSNPOMTKFZDHZ-XJCFNFQFSA-N
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Elements H C N O Cl