Formula |
C13H18ClN5O8P2 |
IUPAC Name |
[4-[2-chloro-6-(methylamino)purin-9-yl]-2-phosphonooxy-1-bicyclo[3.1.0]hexanyl]methyl dihydrogen phosphate |
Molecular Mass |
469.711 g·mol−1 |
Heat of Formation |
-1738.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.21 ± 1.08 D |
Volume |
469.25 Å 3 |
Surface Area |
387.32 Å 2 |
HOMO Energy |
-8.86 ± 0.55 eV |
LUMO Energy |
2.47 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
NDCFGYFBDZLTJB-UNVHBQKTSA-N |
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Links |
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Elements |
C
Cl
H
O
N
P
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