methylidenezirconium(2+); 2,4,4-trimethyl-1,5,6,7-tetrahydroinden-1-ide; dichloride

Systemtic Name: methylidenezirconium(2+); 2,4,4-trimethyl-1,5,6,7-tetrahydroinden-1-ide; dichloride Openeye Name: methylenezirconium(2+); 2,4,4-trimethyl-1,5,6,7-tetrahydroinden-1-ide; dichloride CAS Name: methylenezirconium(2+); 2,4,4-trimethyl-1,5,6,7-tetrahydroinden-1-ide; dichloride IUPAC Name: methylidenezirconium(2+); 2,4,4-trimethyl-1,5,6,7-tetrahydroinden-1-ide; dichloride Traditional Name: methylenezirconium(2+); 2,4,4-trimethyl-1,5,6,7-tetrahydroinden-1-ide; dichloride Formula: C50H72Cl2Zr2-2 MolecularWeight: 926.46068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C([CH-]1)CCCC2(C)C.CC1=CC2=C([CH-]1)CCCC2(C)C.CC1=CC2=C([CH-]1)CCCC2(C)C.CC1=CC2=C([CH-]1)CCCC2(C)C.C=[Zr+2].C=[Zr+2].[Cl-].[Cl-]

Isomeric SMILES

CC1=CC2=C([CH-]1)CCCC2(C)C.CC1=CC2=C([CH-]1)CCCC2(C)C.CC1=CC2=C([CH-]1)CCCC2(C)C.CC1=CC2=C([CH-]1)CCCC2(C)C.C=[Zr+2].C=[Zr+2].[Cl-].[Cl-]

InChI

InChI=1S/4C12H17.2CH2.2ClH.2Zr/c4*1-9-7-10-5-4-6-12(2,3)11(10)8-9;;;;;;/h4*7-8H,4-6H2,1-3H3;2*1H2;2*1H;;/q4*-1;;;;;2*+2/p-2