bis(3-methanidyl-2-methyl-7-phenyl-3H-inden-1-yl)-diphenyl-silane; zirconium(2+)

Systemtic Name: bis(3-methanidyl-2-methyl-7-phenyl-3H-inden-1-yl)-diphenyl-silane; zirconium(2+) Openeye Name: bis(3-methanidyl-2-methyl-7-phenyl-3H-inden-1-yl)-diphenyl-silane; zirconium(2+) CAS Name: bis(3-methanidyl-2-methyl-7-phenyl-3H-inden-1-yl)-diphenylsilane; zirconium(2+) IUPAC Name: bis(3-methanidyl-2-methyl-7-phenyl-3H-inden-1-yl)-diphenylsilane; zirconium(2+) Traditional Name: bis(3-methanidyl-2-methyl-7-phenyl-3H-inden-1-yl)-diphenyl-silane; zirconium(2+) Formula: C46H38SiZr MolecularWeight: 710.10342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=CC=C2C1[CH2-])C3=CC=CC=C3)[Si](C4=CC=CC=C4)(C5=CC=CC=C5)C6=C(C(C7=CC=CC(=C76)C8=CC=CC=C8)[CH2-])C.[Zr+2]

Isomeric SMILES

CC1=C(C2=C(C=CC=C2C1[CH2-])C3=CC=CC=C3)[Si](C4=CC=CC=C4)(C5=CC=CC=C5)C6=C(C(C7=CC=CC(=C76)C8=CC=CC=C8)[CH2-])C.[Zr+2]

InChI

InChI=1S/C46H38Si.Zr/c1-31-33(3)45(43-39(31)27-17-29-41(43)35-19-9-5-10-20-35)47(37-23-13-7-14-24-37,38-25-15-8-16-26-38)46-34(4)32(2)40-28-18-30-42(44(40)46)36-21-11-6-12-22-36;/h5-32H,1-2H2,3-4H3;/q-2;+2