bis(2-ethyl-3-naphthalen-1-yl-inden-2-id-4-yl)-diphenyl-silane; zirconium(4+); dichloride

Systemtic Name: bis(2-ethyl-3-naphthalen-1-yl-inden-2-id-4-yl)-diphenyl-silane; zirconium(4+); dichloride Openeye Name: bis[2-ethyl-3-(1-naphthyl)inden-2-id-4-yl]-diphenyl-silane; zirconium(4+); dichloride CAS Name: bis[2-ethyl-3-(1-naphthalenyl)-4-inden-2-idyl]-diphenylsilane; zirconium(4+); dichloride IUPAC Name: bis(2-ethyl-3-naphthalen-1-ylinden-2-id-4-yl)-diphenylsilane; zirconium(4+); dichloride Traditional Name: bis[2-ethyl-3-(1-naphthyl)inden-2-id-4-yl]-diphenyl-silane; zirconium(4+); dichloride Formula: C54H42Cl2SiZr MolecularWeight: 881.12678

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Descriptors Computed from Structure

Canonical SMILES:

CC[C-]1C=C2C=CC=C(C2=C1C3=CC=CC4=CC=CC=C43)[Si](C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC8=C[C-](C(=C87)C9=CC=CC1=CC=CC=C19)CC.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

CC[C-]1C=C2C=CC=C(C2=C1C3=CC=CC4=CC=CC=C43)[Si](C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC8=C[C-](C(=C87)C9=CC=CC1=CC=CC=C19)CC.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/C54H42Si.2ClH.Zr/c1-3-37-35-41-23-17-33-49(53(41)51(37)47-31-15-21-39-19-11-13-29-45(39)47)55(43-25-7-5-8-26-43,44-27-9-6-10-28-44)50-34-18-24-42-36-38(4-2)52(54(42)50)48-32-16-22-40-20-12-14-30-46(40)48;;;/h5-36H,3-4H2,1-2H3;2*1H;/q-2;;;+4/p-2