2-{3-[(5E)-5-{[(2,3-Dichlorophenyl)Carbamoyl]Imino}-3-(2-Thienyl)-2,5-Dihydro-1H-Pyrazol-1-Yl]Phenyl}Acetamide

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Formula C22H17Cl2N5O2S
IUPAC Name 2-[3-[(5e)-5-[(2,3-dichlorophenyl)carbamoylimino]-3-(2-thienyl)pyrazole-1,2-diium-1-yl]phenyl]acetamide
Molecular Mass 486.374 g·mol−1
Heat of Formation 128.7 ± 16.7 kJ·mol−1
Dipole Moment 8.68 ± 1.08 D
Volume 522.7 Å 3
Surface Area 459.38 Å 2
HOMO Energy -8.97 ± 0.55 eV
LUMO Energy -1.69 ± eV
Point Group Symmetry C1
InChIKey YEVPKQHEAVIPSH-NHFJDJAPSA-N
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