Formula |
C16H11ClN4O |
IUPAC Name |
9-benzyl-2-chloro-6-(2-furyl)purin-9-ium |
Molecular Mass |
310.738 g·mol−1 |
Heat of Formation |
378.6 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.26 ± 1.08 D |
Volume |
341.2 Å 3 |
Surface Area |
310.79 Å 2 |
HOMO Energy |
-9.12 ± 0.55 eV |
LUMO Energy |
-1.36 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 2-chloro-6-(2-furyl)-9-(phenylmethyl)purine
- 2-chloro-6-furan-2-yl-9-(phenylmethyl)purine
- 9-(benzyl)-2-chloro-6-(2-furyl)purine
- 9h-purine, 2-chloro-6-(2-furanyl)-9-(phenylmethyl)-
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InChIKey |
OBFGIQXNDDQWEJ-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
C
N
O
Cl
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