2-inden-1-id-1-yl-5-methyl-thiophene; 2-methylcyclopenta[b]phosphole; zirconium(3+); dichloride

Systemtic Name: 2-inden-1-id-1-yl-5-methyl-thiophene; 2-methylcyclopenta[b]phosphole; zirconium(3+); dichloride Openeye Name: 2-inden-1-id-1-yl-5-methyl-thiophene; 2-methylcyclopenta[b]phosphole; zirconium(3+); dichloride CAS Name: 2-(1-inden-1-idyl)-5-methylthiophene; 2-methylcyclopenta[b]phosphole; zirconium(3+); dichloride IUPAC Name: 2-inden-1-id-1-yl-5-methylthiophene; 2-methylcyclopenta[b]phosphole; zirconium(3+); dichloride Traditional Name: 2-inden-1-id-1-yl-5-methyl-thiophene; 2-methylcyclopenta[b]phosphole; zirconium(3+); dichloride Formula: C22H18Cl2PSZr MolecularWeight: 507.547081

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)[C-]2C=CC3=CC=CC=C23.CC1=CC2=CC=CC2=P1.[Cl-].[Cl-].[Zr+3]

Isomeric SMILES

CC1=CC=C(S1)[C-]2C=CC3=CC=CC=C23.CC1=CC2=CC=CC2=P1.[Cl-].[Cl-].[Zr+3]

InChI

InChI=1S/C14H11S.C8H7P.2ClH.Zr/c1-10-6-9-14(15-10)13-8-7-11-4-2-3-5-12(11)13;1-6-5-7-3-2-4-8(7)9-6;;;/h2-9H,1H3;2-5H,1H3;2*1H;/q-1;;;;+3/p-2