Formula |
C24H25FN4O4 |
IUPAC Name |
[2-[4-(4-fluorophenyl)-5-(2h-pyridin-2-ylium-4-yl)-1h-imidazol-3-ium-5-id-2-yl]-5-methyl-1,3-dioxan-5-yl]-morpholino-methanone |
Molecular Mass |
452.478 g·mol−1 |
Heat of Formation |
-505.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.85 ± 1.08 D |
Volume |
517.03 Å 3 |
Surface Area |
436.28 Å 2 |
HOMO Energy |
-9.21 ± 0.55 eV |
LUMO Energy |
2.34 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
YEQUJOKCSZTBFS-HCGLCNNCSA-N |
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Links |
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Elements |
H
C
N
O
F
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