8-Bromo-2'-Deoxy(N~2~,N~8~,6-~15~N_3_)Guanosine

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Properties Simple | Detailed

Formula C10H12BrN5O4
IUPAC Name 2-(15n)azanyl-8-bromo-9-[(2r,4s,5r)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-3h-purin-6-one
Molecular Mass 349.118 g·mol−1
Heat of Formation -436.0 ± 16.7 kJ·mol−1
Dipole Moment 9.71 ± 1.08 D
Volume 313.65 Å 3
Surface Area 269.08 Å 2
HOMO Energy -9.06 ± 0.55 eV
LUMO Energy 2.60 ± eV
Point Group Symmetry C1
InChIKey MKDXZFVCXWXGBQ-SQMQHQJJSA-N
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Elements H C O Br N