Formula |
C10H7BrClN7S2 |
IUPAC Name |
6-(5-bromo-6-chloro-2-methylsulfanyl-pyrimidin-4-yl)sulfanyl-7h-purin-2-amine |
Molecular Mass |
404.696 g·mol−1 |
Heat of Formation |
486.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.59 ± 1.08 D |
Volume |
362.15 Å 3 |
Surface Area |
315.49 Å 2 |
HOMO Energy |
-8.81 ± 0.55 eV |
LUMO Energy |
0.54 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 1h-purin-2-amine, 6-((5-bromo-6-chloro-2-(methylthio)-4-pyrimidinyl)thio)-
- 1h-purin-2-amine, 6-[[5-bromo-6-chloro-2-(methylthio)-4-pyrimidinyl]thio]-
- 6-(5-bromo-6-chloro-2-methylsulfanyl-pyrimidin-4-yl)sulfanyl-7h-purin-2-amine
- 6-[[5-bromo-6-chloro-2-(methylthio)-4-pyrimidinyl]thio]-7h-purin-2-amine
- [6-[[5-bromo-6-chloro-2-(methylthio)pyrimidin-4-yl]thio]-7h-purin-2-yl]amine
- kc 515
- purine, 2-amino-6-[[5-bromo-6-chloro-2-(methylthio)-4-pyrimidinyl]thio]-
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CAS Number(s) |
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InChIKey |
HCIPRXPENNHLHS-UHFFFAOYSA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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Elements |
C
Cl
H
N
S
Br
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