4-Chlorobenzenecarbothioamide

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Properties Simple | Detailed

Formula C7H6ClNS
IUPAC Name 4-chlorobenzenecarbothioamide
Molecular Mass 171.647 g·mol−1
Heat of Formation 129.7 ± 16.7 kJ·mol−1
Dipole Moment 4.65 ± 1.08 D
Volume 192.21 Å 3
Surface Area 188.96 Å 2
HOMO Energy -8.65 ± 0.55 eV
LUMO Energy 2.05 ± eV
Point Group Symmetry C1
Synonyms
  • 4-chlorothiobenzamide
  • benzamide, p-chlorothio-
  • benzamide, p-chlorothio- (8ci)
  • benzenecarbothioamide, 4-chloro-
  • benzenecarbothioamide, 4-chloro- (9ci)
  • p-chlorobenzothiamide
  • p-chlorothiobenzamide
CAS Number(s)
  • 2521-24-6
InChIKey OKPUICCJRDBRJT-UHFFFAOYSA-N
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Elements H S N C Cl