2-Bromo-9-(3-Deoxypentofuranosyl)-9H-Purin-6-Amine

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Formula C10H12BrN5O3
IUPAC Name (2r,3r,5s)-2-(6-amino-2-bromo-purine-1,3,7-triium-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3-ol
Molecular Mass 330.138 g·mol−1
Heat of Formation -294.7 ± 16.7 kJ·mol−1
Dipole Moment 2.52 ± 1.08 D
Volume 306.59 Å 3
Surface Area 265.81 Å 2
HOMO Energy -9.27 ± 0.55 eV
LUMO Energy -1.16 ± eV
Point Group Symmetry C1
InChIKey MOFDAKHUBHRTST-OBXARNEKSA-O
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Elements H C O Br N