calcium 2,3,4,5,6-pentakis(chloranyl)benzenethiolate

Systemtic Name: calcium 2,3,4,5,6-pentakis(chloranyl)benzenethiolate Openeye Name: calcium 2,3,4,5,6-pentachlorobenzenethiolate CAS Name: calcium 2,3,4,5,6-pentachlorobenzenethiolate IUPAC Name: calcium 2,3,4,5,6-pentachlorobenzenethiolate Traditional Name: calcium 2,3,4,5,6-pentachlorobenzenethiolate Formula: C12CaCl10S2 MolecularWeight: 602.8664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)[S-].C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)[S-].[Ca+2]

Isomeric SMILES

C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)[S-].C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)[S-].[Ca+2]

InChI

InChI=1S/2C6HCl5S.Ca/c2*7-1-2(8)4(10)6(12)5(11)3(1)9;/h2*12H;/q;;+2/p-2