[4-(4-Chlorophenyl)-1-[4-(4-Fluorophenyl)-4-Oxo-Butyl]-4-Piperidyl] 4-Azidobenzoate

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Properties Simple | Detailed

Formula C28H27ClFN4O3
IUPAC Name [4-(4-chlorophenyl)-1-[4-(4-fluorophenyl)-4-oxo-butyl]-4-piperidyl] 4-azidobenzoate
Molecular Mass 521.990 g·mol−1
Heat of Formation -164.0 ± 16.7 kJ·mol−1
Dipole Moment 2.98 ± 1.08 D
Volume 605.81 Å 3
Surface Area 512.85 Å 2
HOMO Energy -9.13 ± 0.55 eV
LUMO Energy 1.76 ± eV
Point Group Symmetry C1
InChIKey DGOMZUUWKTXABS-UHFFFAOYSA-N
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Elements C F H Cl O N