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3-(dicyclopentylmethyl)-1H-inden-1-ide; propan-2-ylidenezirconium(2+); dichloride
3-(dicyclopentylmethyl)-1H-inden-1-ide; propan-2-ylidenezirconium(2+); dichloride
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Canonical SMILES:
CC(=[Zr+2])C.CC(=[Zr+2])C.C1CCC(C1)C(C2CCCC2)C3=C[CH-]C4=CC=CC=C43.C1CCC(C1)C(C2CCCC2)C3=C[CH-]C4=CC=CC=C43.C1CCC(C1)C(C2CCCC2)C3=C[CH-]C4=CC=CC=C43.C1CCC(C1)C(C2CCCC2)C3=C[CH-]C4=CC=CC=C43.[Cl-].[Cl-]
Isomeric SMILES
CC(=[Zr+2])C.CC(=[Zr+2])C.C1CCC(C1)C(C2CCCC2)C3=C[CH-]C4=CC=CC=C43.C1CCC(C1)C(C2CCCC2)C3=C[CH-]C4=CC=CC=C43.C1CCC(C1)C(C2CCCC2)C3=C[CH-]C4=CC=CC=C43.C1CCC(C1)C(C2CCCC2)C3=C[CH-]C4=CC=CC=C43.[Cl-].[Cl-]
InChI
InChI=1S/4C20H25.2C3H6.2ClH.2Zr/c4*1-2-9-16(8-1)20(17-10-3-4-11-17)19-14-13-15-7-5-6-12-18(15)19;2*1-3-2;;;;/h4*5-7,12-14,16-17,20H,1-4,8-11H2;2*1-2H3;2*1H;;/q4*-1;;;;;2*+2/p-2
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