4-methyl-9-phenyl-1,9-dihydrofluoren-1-ide; zirconium(2+); dichloride

Systemtic Name: 4-methyl-9-phenyl-1,9-dihydrofluoren-1-ide; zirconium(2+); dichloride Openeye Name: 4-methyl-9-phenyl-1,9-dihydrofluoren-1-ide; zirconium(2+); dichloride CAS Name: 4-methyl-9-phenyl-1,9-dihydrofluoren-1-ide; zirconium(2+); dichloride IUPAC Name: 4-methyl-9-phenyl-1,9-dihydrofluoren-1-ide; zirconium(2+); dichloride Traditional Name: 4-methyl-9-phenyl-1,9-dihydrofluoren-1-ide; zirconium(2+); dichloride Formula: C80H60Cl2Zr2-2 MolecularWeight: 1274.6864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=[C-]C2=C1C3=CC=CC=C3C2C4=CC=CC=C4.CC1=CC=[C-]C2=C1C3=CC=CC=C3C2C4=CC=CC=C4.CC1=CC=[C-]C2=C1C3=CC=CC=C3C2C4=CC=CC=C4.CC1=CC=[C-]C2=C1C3=CC=CC=C3C2C4=CC=CC=C4.[Cl-].[Cl-].[Zr+2].[Zr+2]

Isomeric SMILES

CC1=CC=[C-]C2=C1C3=CC=CC=C3C2C4=CC=CC=C4.CC1=CC=[C-]C2=C1C3=CC=CC=C3C2C4=CC=CC=C4.CC1=CC=[C-]C2=C1C3=CC=CC=C3C2C4=CC=CC=C4.CC1=CC=[C-]C2=C1C3=CC=CC=C3C2C4=CC=CC=C4.[Cl-].[Cl-].[Zr+2].[Zr+2]

InChI

InChI=1S/4C20H15.2ClH.2Zr/c4*1-14-8-7-13-18-19(14)16-11-5-6-12-17(16)20(18)15-9-3-2-4-10-15;;;;/h4*2-12,20H,1H3;2*1H;;/q4*-1;;;2*+2/p-2