3,5-Dichloro-3'-[(Diethylamino)Methyl]-N-(1,3,5-Trimethyl-1H-Pyrazol-4-Yl)-4-Biphenylsulfonamide

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Formula C23H28Cl2N4O2S
IUPAC Name 2,6-dichloro-4-[3-(diethylaminomethyl)phenyl]-n-(1,3,5-trimethylpyrazol-1-ium-3-ylium-4-yl)benzenesulfonamide
Molecular Mass 495.465 g·mol−1
Heat of Formation -135.8 ± 16.7 kJ·mol−1
Dipole Moment 8.01 ± 1.08 D
Volume 566.55 Å 3
Surface Area 443.55 Å 2
HOMO Energy -8.98 ± 0.55 eV
LUMO Energy 1.89 ± eV
Point Group Symmetry C1
InChIKey AGAPYTXFHCVDOQ-UHFFFAOYSA-N
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Elements C Cl H O N S