1H-inden-1-id-2-yl(dipropyl)phosphane; 2-methyl-4-phenyl-1H-inden-1-ide; zirconium(2+); dichloride

Systemtic Name: 1H-inden-1-id-2-yl(dipropyl)phosphane; 2-methyl-4-phenyl-1H-inden-1-ide; zirconium(2+); dichloride Openeye Name: 1H-inden-1-id-2-yl(dipropyl)phosphane; 2-methyl-4-phenyl-1H-inden-1-ide; zirconium(2+); dichloride CAS Name: 1H-inden-1-id-2-yl(dipropyl)phosphine; 2-methyl-4-phenyl-1H-inden-1-ide; zirconium(2+); dichloride IUPAC Name: 1H-inden-1-id-2-yl(dipropyl)phosphane; 2-methyl-4-phenyl-1H-inden-1-ide; zirconium(2+); dichloride Traditional Name: 1H-inden-1-id-2-yl(dipropyl)phosphine; 2-methyl-4-phenyl-1H-inden-1-ide; zirconium(2+); dichloride Formula: C62H66Cl2P2Zr2-2 MolecularWeight: 1126.488962

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Descriptors Computed from Structure

Canonical SMILES:

CCCP(CCC)C1=CC2=CC=CC=C2[CH-]1.CCCP(CCC)C1=CC2=CC=CC=C2[CH-]1.CC1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=C3.CC1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=C3.[Cl-].[Cl-].[Zr+2].[Zr+2]

Isomeric SMILES

CCCP(CCC)C1=CC2=CC=CC=C2[CH-]1.CCCP(CCC)C1=CC2=CC=CC=C2[CH-]1.CC1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=C3.CC1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=C3.[Cl-].[Cl-].[Zr+2].[Zr+2]

InChI

InChI=1S/2C16H13.2C15H20P.2ClH.2Zr/c2*1-12-10-14-8-5-9-15(16(14)11-12)13-6-3-2-4-7-13;2*1-3-9-16(10-4-2)15-11-13-7-5-6-8-14(13)12-15;;;;/h2*2-11H,1H3;2*5-8,11-12H,3-4,9-10H2,1-2H3;2*1H;;/q4*-1;;;2*+2/p-2