Formula |
C26H26FN3O |
IUPAC Name |
3-fluoro-4-[4-methoxy-3-[[[(2s,3s)-2-phenyl-3-piperidyl]amino]methyl]phenyl]benzonitrile |
Molecular Mass |
415.503 g·mol−1 |
Heat of Formation |
25.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.70 ± 1.08 D |
Volume |
507.54 Å 3 |
Surface Area |
391.8 Å 2 |
HOMO Energy |
-8.68 ± 0.55 eV |
LUMO Energy |
1.93 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 3-fluoro-4-[4-methoxy-3-[[[(2s,3s)-2-phenyl-3-piperidinyl]amino]methyl]phenyl]benzonitrile
- 3-fluoro-4-[4-methoxy-3-[[[(2s,3s)-2-phenyl-3-piperidyl]amino]methyl]phenyl]benzonitrile
- 3-fluoro-4-[4-methoxy-3-[[[(2s,3s)-2-phenylpiperidin-3-yl]amino]methyl]phenyl]benzonitrile
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InChIKey |
BJOOHYLOKXAENV-AHWVRZQESA-N |
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Links |
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Downloads |
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Elements |
H
C
N
O
F
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