bis(1-methanidyl-2-methyl-3-naphthalen-1-yl-1H-inden-4-yl)-diphenyl-silane; zirconium(2+)

Systemtic Name: bis(1-methanidyl-2-methyl-3-naphthalen-1-yl-1H-inden-4-yl)-diphenyl-silane; zirconium(2+) Openeye Name: bis[1-methanidyl-2-methyl-3-(1-naphthyl)-1H-inden-4-yl]-diphenyl-silane; zirconium(2+) CAS Name: bis[1-methanidyl-2-methyl-3-(1-naphthalenyl)-1H-inden-4-yl]-diphenylsilane; zirconium(2+) IUPAC Name: bis(1-methanidyl-2-methyl-3-naphthalen-1-yl-1H-inden-4-yl)-diphenylsilane; zirconium(2+) Traditional Name: bis[1-methanidyl-2-methyl-3-(1-naphthyl)-1H-inden-4-yl]-diphenyl-silane; zirconium(2+) Formula: C54H42SiZr MolecularWeight: 810.22078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C1[CH2-])C=CC=C2[Si](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC6=C5C(=C(C6[CH2-])C)C7=CC=CC8=CC=CC=C87)C9=CC=CC1=CC=CC=C19.[Zr+2]

Isomeric SMILES

CC1=C(C2=C(C1[CH2-])C=CC=C2[Si](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC6=C5C(=C(C6[CH2-])C)C7=CC=CC8=CC=CC=C87)C9=CC=CC1=CC=CC=C19.[Zr+2]

InChI

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