2,5-dimethyl-4-propan-2-yl-1H-inden-1-ide; dimethylsilylidenezirconium(2+); dichloride

Systemtic Name: 2,5-dimethyl-4-propan-2-yl-1H-inden-1-ide; dimethylsilylidenezirconium(2+); dichloride Openeye Name: dimethylsilylidenezirconium(2+); 4-isopropyl-2,5-dimethyl-1H-inden-1-ide; dichloride CAS Name: 2,5-dimethyl-4-propan-2-yl-1H-inden-1-ide; dimethylsilylidenezirconium(2+); dichloride IUPAC Name: 2,5-dimethyl-4-propan-2-yl-1H-inden-1-ide; dimethylsilylidenezirconium(2+); dichloride Traditional Name: dimethylsilylidenezirconium(2+); 4-isopropyl-2,5-dimethyl-1H-inden-1-ide; dichloride Formula: C60H80Cl2Si2Zr2-2 MolecularWeight: 1110.8022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C([CH-]1)C=CC(=C2C(C)C)C.CC1=CC2=C([CH-]1)C=CC(=C2C(C)C)C.CC1=CC2=C([CH-]1)C=CC(=C2C(C)C)C.CC1=CC2=C([CH-]1)C=CC(=C2C(C)C)C.C[Si](=[Zr+2])C.C[Si](=[Zr+2])C.[Cl-].[Cl-]

Isomeric SMILES

CC1=CC2=C([CH-]1)C=CC(=C2C(C)C)C.CC1=CC2=C([CH-]1)C=CC(=C2C(C)C)C.CC1=CC2=C([CH-]1)C=CC(=C2C(C)C)C.CC1=CC2=C([CH-]1)C=CC(=C2C(C)C)C.C[Si](=[Zr+2])C.C[Si](=[Zr+2])C.[Cl-].[Cl-]

InChI

InChI=1S/4C14H17.2C2H6Si.2ClH.2Zr/c4*1-9(2)14-11(4)5-6-12-7-10(3)8-13(12)14;2*1-3-2;;;;/h4*5-9H,1-4H3;2*1-2H3;2*1H;;/q4*-1;;;;;2*+2/p-2