1,9-dihydrofluoren-1-ide; 2-methyl-1H-inden-1-ide; zirconium(2+); dichloride

Systemtic Name: 1,9-dihydrofluoren-1-ide; 2-methyl-1H-inden-1-ide; zirconium(2+); dichloride Openeye Name: 1,9-dihydrofluoren-1-ide; 2-methyl-1H-inden-1-ide; zirconium(2+); dichloride CAS Name: 1,9-dihydrofluoren-1-ide; 2-methyl-1H-inden-1-ide; zirconium(2+); dichloride IUPAC Name: 1,9-dihydrofluoren-1-ide; 2-methyl-1H-inden-1-ide; zirconium(2+); dichloride Traditional Name: 1,9-dihydrofluoren-1-ide; 2-methyl-1H-inden-1-ide; zirconium(2+); dichloride Formula: C46H36Cl2Zr2-2 MolecularWeight: 842.13204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC=CC=C2[CH-]1.CC1=CC2=CC=CC=C2[CH-]1.C1C2=CC=CC=C2C3=C1[C-]=CC=C3.C1C2=CC=CC=C2C3=C1[C-]=CC=C3.[Cl-].[Cl-].[Zr+2].[Zr+2]

Isomeric SMILES

CC1=CC2=CC=CC=C2[CH-]1.CC1=CC2=CC=CC=C2[CH-]1.C1C2=CC=CC=C2C3=C1[C-]=CC=C3.C1C2=CC=CC=C2C3=C1[C-]=CC=C3.[Cl-].[Cl-].[Zr+2].[Zr+2]

InChI

InChI=1S/2C13H9.2C10H9.2ClH.2Zr/c2*1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12;2*1-8-6-9-4-2-3-5-10(9)7-8;;;;/h2*1-5,7-8H,9H2;2*2-7H,1H3;2*1H;;/q4*-1;;;2*+2/p-2