(3E,5E)-3,5-Bis(4-Fluorobenzylidene)-1-[(1-Hydroxy-2,2,5,5-Tetramethyl-2,5-Dihydro-1H-Pyrrol-3-Yl)Methyl]-4-Piperidinone

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Properties Simple | Detailed

Formula C28H31F2N2O2+
IUPAC Name (3e,5e)-3,5-bis[(4-fluorophenyl)methylene]-1-[[(1s)-1-hydroxy-2,2,5,5-tetramethyl-pyrrol-3-yl]methyl]piperidin-4-one
Molecular Mass 465.555 g·mol−1
Heat of Formation -306.4 ± 16.7 kJ·mol−1
Dipole Moment 2.25 ± 1.08 D
Volume 575.38 Å 3
Surface Area 432.67 Å 2
HOMO Energy -9.21 ± 0.55 eV
LUMO Energy 2.19 ± eV
Point Group Symmetry C1
InChIKey PWZQFTQMMAIRRM-JFMUQQRKSA-N
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