Formula |
C17H19FN4 |
IUPAC Name |
2-[4-(4-fluorophenyl)-3-(3h-pyrrol-1-ium-3-id-1-yl)pyrazol-1-ium-4-id-1-yl]-n,n-dimethyl-ethanamine |
Molecular Mass |
298.358 g·mol−1 |
Heat of Formation |
232.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.44 ± 1.08 D |
Volume |
369.47 Å 3 |
Surface Area |
335.18 Å 2 |
HOMO Energy |
-8.66 ± 0.55 eV |
LUMO Energy |
2.78 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
ZCQVHVWVDAEXBJ-UHFFFAOYSA-N |
QR Code |
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Elements |
H
C
F
N
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