dibutyl(1H-inden-1-id-2-yl)phosphane; 2-pentan-2-ylcyclopenta-1,3-diene; zirconium(2+); dichloride

Systemtic Name: dibutyl(1H-inden-1-id-2-yl)phosphane; 2-pentan-2-ylcyclopenta-1,3-diene; zirconium(2+); dichloride Openeye Name: dibutyl(1H-inden-1-id-2-yl)phosphane; 2-(1-methylbutyl)cyclopenta-1,3-diene; zirconium(2+); dichloride CAS Name: dibutyl(1H-inden-1-id-2-yl)phosphine; 2-pentan-2-ylcyclopenta-1,3-diene; zirconium(2+); dichloride IUPAC Name: dibutyl(1H-inden-1-id-2-yl)phosphane; 2-pentan-2-ylcyclopenta-1,3-diene; zirconium(2+); dichloride Traditional Name: dibutyl(1H-inden-1-id-2-yl)phosphine; 2-(1-methylbutyl)cyclopenta-1,3-diene; zirconium(2+); dichloride Formula: C54H78Cl2P2Zr2-2 MolecularWeight: 1042.498642

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Descriptors Computed from Structure

Canonical SMILES:

CCCCP(CCCC)C1=CC2=CC=CC=C2[CH-]1.CCCCP(CCCC)C1=CC2=CC=CC=C2[CH-]1.CCCC(C)C1=[C-]CC=C1.CCCC(C)C1=[C-]CC=C1.[Cl-].[Cl-].[Zr+2].[Zr+2]

Isomeric SMILES

CCCCP(CCCC)C1=CC2=CC=CC=C2[CH-]1.CCCCP(CCCC)C1=CC2=CC=CC=C2[CH-]1.CCCC(C)C1=[C-]CC=C1.CCCC(C)C1=[C-]CC=C1.[Cl-].[Cl-].[Zr+2].[Zr+2]

InChI

InChI=1S/2C17H24P.2C10H15.2ClH.2Zr/c2*1-3-5-11-18(12-6-4-2)17-13-15-9-7-8-10-16(15)14-17;2*1-3-6-9(2)10-7-4-5-8-10;;;;/h2*7-10,13-14H,3-6,11-12H2,1-2H3;2*4,7,9H,3,5-6H2,1-2H3;2*1H;;/q4*-1;;;2*+2/p-2