(3R,4S,7S)-7-(4-Chlorophenyl)-2-(4-Fluorophenyl)-7-Hydroxy-3-(4-Hydroxyphenyl)-2-Azaspiro[3.5]Nonan-1-One

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Formula C26H23ClFNO3
IUPAC Name (1r)-7-(4-chlorophenyl)-2-(4-fluorophenyl)-7-hydroxy-1-(4-hydroxyphenyl)-2-azaspiro[3.5]nonan-3-one
Molecular Mass 451.917 g·mol−1
Heat of Formation -471.2 ± 16.7 kJ·mol−1
Dipole Moment 2.68 ± 1.08 D
Volume 515.48 Å 3
Surface Area 416.46 Å 2
HOMO Energy -8.85 ± 0.55 eV
LUMO Energy -0.46 ± eV
Point Group Symmetry C1
InChIKey DPZUDTYEZMUJDW-ARMFNRFLSA-N
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Elements C F H Cl O N