dimethyl-bis(2-methyl-3-phenanthren-4-yl-3H-inden-1-yl)silane; zirconium(2+); dichloride

Systemtic Name: dimethyl-bis(2-methyl-3-phenanthren-4-yl-3H-inden-1-yl)silane; zirconium(2+); dichloride Openeye Name: dimethyl-bis[2-methyl-3-(4-phenanthryl)-3H-inden-1-yl]silane; zirconium(2+); dichloride CAS Name: dimethyl-bis[2-methyl-3-(4-phenanthrenyl)-3H-inden-1-yl]silane; zirconium(2+); dichloride IUPAC Name: dimethyl-bis(2-methyl-3-phenanthren-4-yl-3H-inden-1-yl)silane; zirconium(2+); dichloride Traditional Name: dimethyl-bis[2-methyl-3-(4-phenanthryl)-3H-inden-1-yl]silane; zirconium(2+); dichloride Formula: C50H40Cl2SiZr MolecularWeight: 831.0681

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2C1C3=CC=CC4=C3C5=CC=CC=C5C=C4)[Si](C)(C)C6=C(C(C7=CC=CC=C76)C8=CC=CC9=C8C1=CC=CC=C1C=C9)C.[Cl-].[Cl-].[Zr+2]

Isomeric SMILES

CC1=C(C2=CC=CC=C2C1C3=CC=CC4=C3C5=CC=CC=C5C=C4)[Si](C)(C)C6=C(C(C7=CC=CC=C76)C8=CC=CC9=C8C1=CC=CC=C1C=C9)C.[Cl-].[Cl-].[Zr+2]

InChI

InChI=1S/C50H40Si.2ClH.Zr/c1-31-45(43-25-13-17-35-29-27-33-15-5-7-19-37(33)47(35)43)39-21-9-11-23-41(39)49(31)51(3,4)50-32(2)46(40-22-10-12-24-42(40)50)44-26-14-18-36-30-28-34-16-6-8-20-38(34)48(36)44;;;/h5-30,45-46H,1-4H3;2*1H;/q;;;+2/p-2