Formula |
C8H9ClN4S |
IUPAC Name |
6-(3-chloropropylsulfanyl)-7h-purine |
Molecular Mass |
228.702 g·mol−1 |
Heat of Formation |
224.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.47 ± 1.08 D |
Volume |
249.19 Å 3 |
Surface Area |
236.97 Å 2 |
HOMO Energy |
-9.12 ± 0.55 eV |
LUMO Energy |
-1.25 ± eV |
Point Group Symmetry |
C1
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Synonyms
|
- 3-chloropropyl 9h-purin-6-yl sulfide
- 6-(3-chloropropylsulfanyl)-7h-purine
- 6-(3-chloropropylthio)-7h-purine
- ag-205/12075179
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InChIKey |
GQRSREIDTVAUEO-UHFFFAOYSA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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Elements |
H
S
N
C
Cl
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