Formula |
C12H18N4S |
IUPAC Name |
6-heptylsulfanyl-7h-purine |
Molecular Mass |
250.363 g·mol−1 |
Heat of Formation |
153.6 ± 16.7 kJ·mol−1 |
Dipole Moment |
1.80 ± 1.08 D |
Volume |
308.63 Å 3 |
Surface Area |
299.61 Å 2 |
HOMO Energy |
-8.67 ± 0.55 eV |
LUMO Energy |
1.97 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 1h-purine, 6-(heptylthio)-
- 6-(heptylthio)-1h-purine
- 6-(heptylthio)-7h-purine
- 6-heptylsulfanyl-7h-purine
- 6-n-heptylmercaptopurine
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CAS Number(s) |
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InChIKey |
AJMDBPAFRPBUDE-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
C
N
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