Formula |
C24H25FN4O2 |
IUPAC Name |
[(2r,5r)-5-[(5-fluoro-2-pyridyl)oxymethyl]-2-methyl-1-piperidyl]-(5-methyl-2-pyrimidin-2-yl-phenyl)methanone |
Molecular Mass |
420.479 g·mol−1 |
Heat of Formation |
-239.6 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.82 ± 1.08 D |
Volume |
501.45 Å 3 |
Surface Area |
376.21 Å 2 |
HOMO Energy |
-9.09 ± 0.55 eV |
LUMO Energy |
-0.66 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
NPFDWHQSDBWQLH-QZTJIDSGSA-N |
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Elements |
H
C
N
O
F
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