cyclopenta-1,3-diene; 2-methylazanidylbenzenethiolate; titanium; iodide

Systemtic Name: cyclopenta-1,3-diene; 2-methylazanidylbenzenethiolate; titanium; iodide Openeye Name: cyclopenta-1,3-diene; 2-methylazanidylbenzenethiolate; titanium; iodide CAS Name: cyclopenta-1,3-diene; 2-methylazanidylbenzenethiolate; titanium; iodide IUPAC Name: cyclopenta-1,3-diene; 2-methylazanidylbenzenethiolate; titanium; iodide Traditional Name: cyclopenta-1,3-diene; 2-methylazanidylbenzenethiolate; titanium; iodide Formula: C17H17INSTi-5 MolecularWeight: 442.16005

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Descriptors Computed from Structure

Canonical SMILES:

C[N-]C1=CC=CC=C1[S-].[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Ti].[I-]

Isomeric SMILES

C[N-]C1=CC=CC=C1[S-].[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Ti].[I-]

InChI

InChI=1S/C7H8NS.2C5H5.HI.Ti/c1-8-6-4-2-3-5-7(6)9;2*1-2-4-5-3-1;;/h2-5,9H,1H3;2*1-5H;1H;/q3*-1;;/p-2