chloranyltitanium(3+); cyclopentane; dibenzothiophene-4-thiolate

Systemtic Name: chloranyltitanium(3+); cyclopentane; dibenzothiophene-4-thiolate Openeye Name: chlorotitanium(3+); cyclopentane; dibenzothiophene-4-thiolate CAS Name: chlorotitanium(3+); cyclopentane; 4-dibenzothiophenethiolate IUPAC Name: chlorotitanium(3+); cyclopentane; dibenzothiophene-4-thiolate Traditional Name: chlorotitanium(3+); cyclopentane; dibenzothiophene-4-thiolate Formula: C22H17ClS2Ti+2 MolecularWeight: 428.82038

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(S2)C(=CC=C3)[S-].[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.Cl[Ti+3]

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(S2)C(=CC=C3)[S-].[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.Cl[Ti+3]

InChI

InChI=1S/C12H8S2.2C5H5.ClH.Ti/c13-10-6-3-5-9-8-4-1-2-7-11(8)14-12(9)10;2*1-2-4-5-3-1;;/h1-7,13H;2*1-5H;1H;/q;;;;+4/p-2