1-[(2R)-2-[(4-Chlorobenzyl)Sulfanyl]-2-(2,4-Dichlorophenyl)Ethyl]-1H-Imidazole

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Properties Simple | Detailed

Formula C18H15Cl3N2S
IUPAC Name 1-[(2r)-2-[(4-chlorophenyl)methylsulfanyl]-2-(2,4-dichlorophenyl)ethyl]imidazole
Molecular Mass 397.749 g·mol−1
Heat of Formation 182.6 ± 16.7 kJ·mol−1
Dipole Moment 4.91 ± 1.08 D
Volume 430.76 Å 3
Surface Area 323.39 Å 2
HOMO Energy -9.21 ± 0.55 eV
LUMO Energy -0.86 ± eV
Point Group Symmetry C1
Synonyms
  • 1-[(2r)-2-[(4-chlorobenzyl)thio]-2-(2,4-dichlorophenyl)ethyl]imidazole
  • 1-[(2r)-2-[(4-chlorophenyl)methylsulfanyl]-2-(2,4-dichlorophenyl)ethyl]imidazole
  • 1-[(2r)-2-[(4-chlorophenyl)methylthio]-2-(2,4-dichlorophenyl)ethyl]imidazole
InChIKey AFNXATANNDIXLG-SFHVURJKSA-N
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Elements H S N C Cl