2-(3-Chloro-2-Fluorobenzyl)-6,7-Dihydroxy-1-Isoindolinone

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Properties Simple | Detailed

Formula C15H11ClFNO3
IUPAC Name 2-[(3-chloro-2-fluoro-phenyl)methyl]-6,7-dihydroxy-isoindolin-1-one
Molecular Mass 307.704 g·mol−1
Heat of Formation -541.1 ± 16.7 kJ·mol−1
Dipole Moment 5.17 ± 1.08 D
Volume 323.9 Å 3
Surface Area 285.97 Å 2
HOMO Energy -9.03 ± 0.55 eV
LUMO Energy -0.79 ± eV
Point Group Symmetry C1
InChIKey ICSLEKWAWMLPBS-UHFFFAOYSA-N
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Elements C F H Cl O N