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

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Formula C10H12ClN5O4
IUPAC Name (2r,3r,4s,5r)-2-(6-amino-2-chloro-purine-1,3,7-triium-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
Molecular Mass 301.686 g·mol−1
Heat of Formation -495.7 ± 16.7 kJ·mol−1
Dipole Moment 2.93 ± 1.08 D
Volume 311.19 Å 3
Surface Area 268.24 Å 2
HOMO Energy -9.41 ± 0.55 eV
LUMO Energy -0.97 ± eV
Point Group Symmetry C1
InChIKey BIXYYZIIJIXVFW-UUOKFMHZSA-O
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Elements H C N O Cl