3,4-Dichlorobenzyl Carbamimidothioate

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Properties Simple | Detailed

Formula C8H8Cl2N2S
IUPAC Name 2-[(3,4-dichlorophenyl)methyl]isothiourea
Molecular Mass 235.134 g·mol−1
Heat of Formation 82.0 ± 16.7 kJ·mol−1
Dipole Moment 4.63 ± 1.08 D
Volume 249.35 Å 3
Surface Area 238.16 Å 2
HOMO Energy -9.13 ± 0.55 eV
LUMO Energy 2.14 ± eV
Point Group Symmetry C1
Synonyms
  • (3,4-dichlorophenyl)methylsulfanylformamidine
  • [(3,4-dichlorobenzyl)thio]formamidine
  • [(3,4-dichlorophenyl)methylthio]formamidine
  • cbdive_010910
InChIKey LZTCFLDZLBOLDW-UHFFFAOYSA-N
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Elements H C N S Cl