Formula |
C11H17BrN5O12P3 |
IUPAC Name |
[(r)-[[[(2r,3s,5r)-5-(2-amino-6-oxo-3h-purin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]-bromo-methyl]phosphonic acid |
Molecular Mass |
584.104 g·mol−1 |
Heat of Formation |
-2682.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
8.35 ± 1.08 D |
Volume |
524.14 Å 3 |
Surface Area |
381.0 Å 2 |
HOMO Energy |
-9.11 ± 0.55 eV |
LUMO Energy |
-1.79 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
NBJGMAKPACFZHS-AVAJSQPUSA-N |
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Links |
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Elements |
C
H
O
N
P
Br
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