Formula |
C21H26FN3O |
IUPAC Name |
6-[[(3r,4r)-4-[(e)-4-(3-fluorophenyl)but-3-enoxy]pyrrolidin-3-yl]methyl]-4-methyl-pyridin-2-amine |
Molecular Mass |
355.449 g·mol−1 |
Heat of Formation |
-177.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.86 ± 1.08 D |
Volume |
447.2 Å 3 |
Surface Area |
407.08 Å 2 |
HOMO Energy |
-8.72 ± 0.55 eV |
LUMO Energy |
-0.74 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
GKGVFZUGOXZFKN-YUOLOVIMSA-N |
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Elements |
H
C
N
O
F
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