N-(2-Aminoethyl)-2,4,5-Trichloro-N-[2-({[(2E)-3-(4-Chlorophenyl)-2-Propen-1-Yl](Methyl)Amino}Methyl)Phenyl]Benzenesulfonamide

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Formula C25H25Cl4N3O2S
IUPAC Name n-(2-aminoethyl)-2,4,5-trichloro-n-[2-[[methyl-[(2e,4e)-4-methylhexa-2,4-dienyl]amino]methyl]phenyl]benzenesulfonamide chloride
Molecular Mass 573.362 g·mol−1
Heat of Formation -92.5 ± 16.7 kJ·mol−1
Dipole Moment 7.29 ± 1.08 D
Volume 626.01 Å 3
Surface Area 486.75 Å 2
HOMO Energy -8.93 ± 0.55 eV
LUMO Energy 1.75 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(n-(2-aminoethyl)-n-(2,4,5-trichlorobenzenesulfonyl))amino-n-(4-chlorocinnamyl)-n-methylbenzylamine
  • hf 2035
  • hf-2035
  • n-(2-aminoethyl)-2,4,5-trichloro-n-[2-[[[(e)-3-(4-chlorophenyl)prop-2-enyl]-methyl-amino]methyl]phenyl]benzenesulfonamide
  • n-(2-aminoethyl)-2,4,5-trichloro-n-[2-[[[(e)-3-(4-chlorophenyl)prop-2-enyl]-methylamino]methyl]phenyl]benzenesulfonamide
CAS Number(s)
  • 176181-81-0
InChIKey VOTNWYFJKIKXJI-SNAWJCMRSA-N
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