bis(4-methylphenyl)silylidenezirconium(2+); 2,3,7-trimethyl-4-propan-2-yl-1H-inden-1-ide; dichloride

Systemtic Name: bis(4-methylphenyl)silylidenezirconium(2+); 2,3,7-trimethyl-4-propan-2-yl-1H-inden-1-ide; dichloride Openeye Name: bis-p-tolylsilylidenezirconium(2+); 4-isopropyl-2,3,7-trimethyl-1H-inden-1-ide; dichloride CAS Name: bis(4-methylphenyl)silylidenezirconium(2+); 2,3,7-trimethyl-4-propan-2-yl-1H-inden-1-ide; dichloride IUPAC Name: bis(4-methylphenyl)silylidenezirconium(2+); 2,3,7-trimethyl-4-propan-2-yl-1H-inden-1-ide; dichloride Traditional Name: bis-p-tolylsilylidenezirconium(2+); 4-isopropyl-2,3,7-trimethyl-1H-inden-1-ide; dichloride Formula: C88H104Cl2Si2Zr2-2 MolecularWeight: 1471.29236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=CC(=C2[CH-]1)C)C(C)C)C.CC1=C(C2=C(C=CC(=C2[CH-]1)C)C(C)C)C.CC1=C(C2=C(C=CC(=C2[CH-]1)C)C(C)C)C.CC1=C(C2=C(C=CC(=C2[CH-]1)C)C(C)C)C.CC1=CC=C(C=C1)[Si](=[Zr+2])C2=CC=C(C=C2)C.CC1=CC=C(C=C1)[Si](=[Zr+2])C2=CC=C(C=C2)C.[Cl-].[Cl-]

Isomeric SMILES

CC1=C(C2=C(C=CC(=C2[CH-]1)C)C(C)C)C.CC1=C(C2=C(C=CC(=C2[CH-]1)C)C(C)C)C.CC1=C(C2=C(C=CC(=C2[CH-]1)C)C(C)C)C.CC1=C(C2=C(C=CC(=C2[CH-]1)C)C(C)C)C.CC1=CC=C(C=C1)[Si](=[Zr+2])C2=CC=C(C=C2)C.CC1=CC=C(C=C1)[Si](=[Zr+2])C2=CC=C(C=C2)C.[Cl-].[Cl-]

InChI

InChI=1S/4C15H19.2C14H14Si.2ClH.2Zr/c4*1-9(2)13-7-6-10(3)14-8-11(4)12(5)15(13)14;2*1-11-3-7-13(8-4-11)15-14-9-5-12(2)6-10-14;;;;/h4*6-9H,1-5H3;2*3-10H,1-2H3;2*1H;;/q4*-1;;;;;2*+2/p-2