Formula |
C29H31ClFNO4 |
IUPAC Name |
(4-chlorophenyl)-[4-[(e)-4-[3-[2-(4-fluorophenyl)ethyl-methyl-amino]propoxy]but-2-enoxy]-2-hydroxy-phenyl]methanone |
Molecular Mass |
512.012 g·mol−1 |
Heat of Formation |
-600.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.37 ± 1.08 D |
Volume |
613.81 Å 3 |
Surface Area |
557.54 Å 2 |
HOMO Energy |
-9.08 ± 0.55 eV |
LUMO Energy |
2.12 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
FTIZLGLUFKODAY-NSCUHMNNSA-N |
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Links |
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Elements |
C
F
H
Cl
O
N
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