Formula |
C19H22FN5 |
IUPAC Name |
3-(3-fluorophenyl)-n-[2-[2-(5-methyl-2h-imidazol-1-ium-2-ylium-1-yl)pyrimidin-4-yl]ethyl]propan-1-amine |
Molecular Mass |
339.410 g·mol−1 |
Heat of Formation |
146.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.98 ± 1.08 D |
Volume |
418.44 Å 3 |
Surface Area |
388.6 Å 2 |
HOMO Energy |
-9.29 ± 0.55 eV |
LUMO Energy |
1.92 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
XNNXUOKGLOGLRV-UHFFFAOYSA-N |
QR Code |
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Links |
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Elements |
H
C
F
N
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