3-[2-(3-Chloro-5-Fluorobenzyl)-1-Benzothiophen-7-Yl]-N-(2-Methoxyethyl)Benzamide

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Properties Simple | Detailed

Formula C25H21ClFNO2S
IUPAC Name 3-[2-[(3-chloro-5-fluoro-phenyl)methyl]benzothiophen-7-yl]-n-(2-methoxyethyl)benzamide
Molecular Mass 453.956 g·mol−1
Heat of Formation -264.5 ± 16.7 kJ·mol−1
Dipole Moment 3.81 ± 1.08 D
Volume 524.09 Å 3
Surface Area 455.02 Å 2
HOMO Energy -8.72 ± 0.55 eV
LUMO Energy -1.09 ± eV
Point Group Symmetry C1
InChIKey YNXYTOJEFCKHEM-UHFFFAOYSA-N
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Elements C F H Cl O N S