2,6-Dichloro-4-[6-(1-Piperazinyl)-3-Pyridinyl]-N-(1,3,5-Trimethyl-1H-Pyrazol-4-Yl)Benzenesulfonamide

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Formula C21H24Cl2N6O2S
IUPAC Name 2,6-dichloro-4-(6-piperazin-1-yl-3-pyridyl)-n-(1,3,5-trimethylpyrazol-1-ium-3-ylium-4-yl)benzenesulfonamide
Molecular Mass 495.425 g·mol−1
Heat of Formation -13.8 ± 16.7 kJ·mol−1
Dipole Moment 10.96 ± 1.08 D
Volume 533.7 Å 3
Surface Area 428.88 Å 2
HOMO Energy -8.58 ± 0.55 eV
LUMO Energy -1.18 ± eV
Point Group Symmetry C1
InChIKey HOIAFTVGAXSASA-UHFFFAOYSA-N
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Elements C Cl H O N S