Formula |
C19H20FN5O2 |
IUPAC Name |
8-[(2,5-dimethoxyphenyl)methyl]-2-fluoro-9-pent-4-ynyl-purin-9-ium-6-amine |
Molecular Mass |
369.393 g·mol−1 |
Heat of Formation |
42.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.19 ± 1.08 D |
Volume |
424.6 Å 3 |
Surface Area |
371.3 Å 2 |
HOMO Energy |
-8.54 ± 0.55 eV |
LUMO Energy |
-0.40 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 8-(2,5-dimethoxy-benzyl)-2-fluoro-9-pent-9h-purin-6-ylamine
- 8-[(2,5-dimethoxyphenyl)methyl]-2-fluoro-9-pent-4-ynyl-6-purinamine
- 8-[(2,5-dimethoxyphenyl)methyl]-2-fluoro-9-pent-4-ynyl-purin-6-amine
- [8-(2,5-dimethoxybenzyl)-2-fluoro-9-pent-4-ynyl-purin-6-yl]amine
- puz
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InChIKey |
RMOYVWKKOKERSW-UHFFFAOYSA-N |
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Links |
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Elements |
H
C
F
O
N
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