5'-Amino-8-Bromo-5'-Deoxyadenosine

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Properties Simple | Detailed

Formula C10H13BrN6O3
IUPAC Name (2r,3r,4s,5r)-2-(6-amino-8-bromo-purin-9-ium-9-yl)-5-(aminomethyl)tetrahydrofuran-3,4-diol
Molecular Mass 345.153 g·mol−1
Heat of Formation -229.7 ± 16.7 kJ·mol−1
Dipole Moment 3.24 ± 1.08 D
Volume 318.65 Å 3
Surface Area 280.63 Å 2
HOMO Energy -9.15 ± 0.55 eV
LUMO Energy 2.20 ± eV
Point Group Symmetry C1
InChIKey WSWAKFOKHOTDLO-UUOKFMHZSA-N
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Elements H C Br O N