bis[2-(5-tert-butylfuran-2-yl)-2-naphthalen-1-yl-3H-inden-3-id-1-yl]-dimethyl-silane; zirconium(4+); dichloride

Systemtic Name: bis[2-(5-tert-butylfuran-2-yl)-2-naphthalen-1-yl-3H-inden-3-id-1-yl]-dimethyl-silane; zirconium(4+); dichloride Openeye Name: bis[2-(5-tert-butyl-2-furyl)-2-(1-naphthyl)-3H-inden-3-id-1-yl]-dimethyl-silane; zirconium(4+); dichloride CAS Name: bis[2-(5-tert-butyl-2-furanyl)-2-(1-naphthalenyl)-3H-inden-3-id-1-yl]-dimethylsilane; zirconium(4+); dichloride IUPAC Name: bis[2-(5-tert-butylfuran-2-yl)-2-naphthalen-1-yl-3H-inden-3-id-1-yl]-dimethylsilane; zirconium(4+); dichloride Traditional Name: bis[2-(5-tert-butyl-2-furyl)-2-(1-naphthyl)-3H-inden-3-id-1-yl]-dimethyl-silane; zirconium(4+); dichloride Formula: C56H50Cl2O2SiZr MolecularWeight: 945.2105

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(O1)C2([C-]=C3C=CC=CC3=C2[Si](C)(C)C4=C5C=CC=CC5=[C-]C4(C6=CC=CC7=CC=CC=C76)C8=CC=C(O8)C(C)(C)C)C9=CC=CC1=CC=CC=C19.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

CC(C)(C)C1=CC=C(O1)C2([C-]=C3C=CC=CC3=C2[Si](C)(C)C4=C5C=CC=CC5=[C-]C4(C6=CC=CC7=CC=CC=C76)C8=CC=C(O8)C(C)(C)C)C9=CC=CC1=CC=CC=C19.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/C56H50O2Si.2ClH.Zr/c1-53(2,3)47-31-33-49(57-47)55(45-29-17-23-37-19-9-13-25-41(37)45)35-39-21-11-15-27-43(39)51(55)59(7,8)52-44-28-16-12-22-40(44)36-56(52,50-34-32-48(58-50)54(4,5)6)46-30-18-24-38-20-10-14-26-42(38)46;;;/h9-34H,1-8H3;2*1H;/q-2;;;+4/p-2