bis(chloranyl)zirconium(2+); bis[4-(4-methoxyphenyl)-2-methyl-4H-azulen-1-id-1-yl]-methyl-phenethyl-silane

Systemtic Name: bis(chloranyl)zirconium(2+); bis[4-(4-methoxyphenyl)-2-methyl-4H-azulen-1-id-1-yl]-methyl-phenethyl-silane Openeye Name: bis[4-(4-methoxyphenyl)-2-methyl-4H-azulen-1-id-1-yl]-methyl-phenethyl-silane; dichlorozirconium(2+) CAS Name: bis[4-(4-methoxyphenyl)-2-methyl-4H-azulen-1-id-1-yl]-methyl-phenethylsilane; dichlorozirconium(2+) IUPAC Name: bis[4-(4-methoxyphenyl)-2-methyl-4H-azulen-1-id-1-yl]-methyl-phenethylsilane; dichlorozirconium(2+) Traditional Name: bis[4-(4-methoxyphenyl)-2-methyl-4H-azulen-1-id-1-yl]-methyl-phenethyl-silane; dichlorozirconium(2+) Formula: C45H44Cl2O2SiZr MolecularWeight: 807.04516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C([C-]1[Si](C)(CCC3=CC=CC=C3)[C-]4C(=CC5=C4C=CC=CC5C6=CC=C(C=C6)OC)C)C=CC=CC2C7=CC=C(C=C7)OC.Cl[Zr+2]Cl

Isomeric SMILES

CC1=CC2=C([C-]1[Si](C)(CCC3=CC=CC=C3)[C-]4C(=CC5=C4C=CC=CC5C6=CC=C(C=C6)OC)C)C=CC=CC2C7=CC=C(C=C7)OC.Cl[Zr+2]Cl

InChI

InChI=1S/C45H44O2Si.2ClH.Zr/c1-31-29-42-38(34-19-23-36(46-3)24-20-34)15-9-11-17-40(42)44(31)48(5,28-27-33-13-7-6-8-14-33)45-32(2)30-43-39(16-10-12-18-41(43)45)35-21-25-37(47-4)26-22-35;;;/h6-26,29-30,38-39H,27-28H2,1-5H3;2*1H;/q-2;;;+4/p-2