bis[7-(4-tert-butylphenyl)-2-ethyl-3H-inden-3-id-1-yl]-dimethyl-silane; zirconium(2+)

Systemtic Name: bis[7-(4-tert-butylphenyl)-2-ethyl-3H-inden-3-id-1-yl]-dimethyl-silane; zirconium(2+) Openeye Name: bis[7-(4-tert-butylphenyl)-2-ethyl-3H-inden-3-id-1-yl]-dimethyl-silane; zirconium(2+) CAS Name: bis[7-(4-tert-butylphenyl)-2-ethyl-3H-inden-3-id-1-yl]-dimethylsilane; zirconium(2+) IUPAC Name: bis[7-(4-tert-butylphenyl)-2-ethyl-3H-inden-3-id-1-yl]-dimethylsilane; zirconium(2+) Traditional Name: bis[7-(4-tert-butylphenyl)-2-ethyl-3H-inden-3-id-1-yl]-dimethyl-silane; zirconium(2+) Formula: C44H50SiZr MolecularWeight: 698.1773

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C([CH-]1)C=CC=C2C3=CC=C(C=C3)C(C)(C)C)[Si](C)(C)C4=C([CH-]C5=C4C(=CC=C5)C6=CC=C(C=C6)C(C)(C)C)CC.[Zr+2]

Isomeric SMILES

CCC1=C(C2=C([CH-]1)C=CC=C2C3=CC=C(C=C3)C(C)(C)C)[Si](C)(C)C4=C([CH-]C5=C4C(=CC=C5)C6=CC=C(C=C6)C(C)(C)C)CC.[Zr+2]

InChI

InChI=1S/C44H50Si.Zr/c1-11-29-27-33-15-13-17-37(31-19-23-35(24-20-31)43(3,4)5)39(33)41(29)45(9,10)42-30(12-2)28-34-16-14-18-38(40(34)42)32-21-25-36(26-22-32)44(6,7)8;/h13-28H,11-12H2,1-10H3;/q-2;+2