Formula |
C10H13BrN5O7P |
IUPAC Name |
[(2r,3s,5r)-5-(2-amino-8-bromo-6-oxo-3h-purin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate |
Molecular Mass |
426.117 g·mol−1 |
Heat of Formation |
-1304.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
14.12 ± 1.08 D |
Volume |
379.79 Å 3 |
Surface Area |
319.21 Å 2 |
HOMO Energy |
-8.76 ± 0.55 eV |
LUMO Energy |
-1.02 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
KUFMHNJQBUZBPA-VPENINKCSA-N |
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Elements |
C
H
O
N
P
Br
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