N-{4-Chloro-3-[(3-Methyl-2-Buten-1-Yl)Oxy]Phenyl}-2-Methyl-3-Thiophenecarbothioamide

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Properties Simple | Detailed

Formula C17H18ClNOS2
IUPAC Name n-[4-chloro-3-(3-methylbut-2-enoxy)phenyl]-2-methyl-thiophene-3-carbothioamide
Molecular Mass 351.914 g·mol−1
Heat of Formation 43.1 ± 16.7 kJ·mol−1
Dipole Moment 2.92 ± 1.08 D
Volume 418.12 Å 3
Surface Area 341.9 Å 2
HOMO Energy -8.54 ± 0.55 eV
LUMO Energy 1.94 ± eV
Point Group Symmetry C1
Synonyms
  • n-[4-chloro-3-(3-methyl-2-butenyloxy)phenyl]-2-methyl-3-thiophenecarbothioamide
  • n-[4-chloro-3-(3-methylbut-2-enoxy)phenyl]-2-methyl-3-thiophenecarbothioamide
  • n-[4-chloro-3-(3-methylbut-2-enoxy)phenyl]-2-methyl-thiophene-3-carbothioamide
  • thiophenecarbothioanilide deriv.
  • uc 82
  • uc-82
  • uc82
InChIKey ORTIQSICVORWBJ-UHFFFAOYSA-N
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