(2Z,5E)-6-[4-(4-Fluorobenzoyl)-1H-Pyrrol-2-Yl]-2-Hydroxy-4-Oxo-2,5-Hexadienoic Acid

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Formula C17H12FNO5
IUPAC Name (2z,5e)-6-[4-(4-fluorobenzoyl)pyrrol-1-ium-2-ylium-2-yl]-2-hydroxy-4-oxo-hexa-2,5-dienoic acid
Molecular Mass 329.279 g·mol−1
Heat of Formation -713.5 ± 16.7 kJ·mol−1
Dipole Moment 5.27 ± 1.08 D
Volume 365.2 Å 3
Surface Area 342.48 Å 2
HOMO Energy -9.51 ± 0.55 eV
LUMO Energy 1.61 ± eV
Point Group Symmetry C1
InChIKey XOINLIFLBUUBGT-RSIRFQHMSA-N
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