1H-inden-1-ide; 8-methyl-1,9-dihydrofluoren-1-ide; zirconium(2+); dichloride

Systemtic Name: 1H-inden-1-ide; 8-methyl-1,9-dihydrofluoren-1-ide; zirconium(2+); dichloride Openeye Name: 1H-inden-1-ide; 8-methyl-1,9-dihydrofluoren-1-ide; zirconium(2+); dichloride CAS Name: 1H-inden-1-ide; 8-methyl-1,9-dihydrofluoren-1-ide; zirconium(2+); dichloride IUPAC Name: 1H-inden-1-ide; 8-methyl-1,9-dihydrofluoren-1-ide; zirconium(2+); dichloride Traditional Name: 1H-inden-1-ide; 8-methyl-1,9-dihydrofluoren-1-ide; zirconium(2+); dichloride Formula: C46H36Cl2Zr2-2 MolecularWeight: 842.13204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1CC3=C2C=CC=[C-]3.CC1=CC=CC2=C1CC3=C2C=CC=[C-]3.[CH-]1C=CC2=CC=CC=C21.[CH-]1C=CC2=CC=CC=C21.[Cl-].[Cl-].[Zr+2].[Zr+2]

Isomeric SMILES

CC1=CC=CC2=C1CC3=C2C=CC=[C-]3.CC1=CC=CC2=C1CC3=C2C=CC=[C-]3.[CH-]1C=CC2=CC=CC=C21.[CH-]1C=CC2=CC=CC=C21.[Cl-].[Cl-].[Zr+2].[Zr+2]

InChI

InChI=1S/2C14H11.2C9H7.2ClH.2Zr/c2*1-10-5-4-8-13-12-7-3-2-6-11(12)9-14(10)13;2*1-2-5-9-7-3-6-8(9)4-1;;;;/h2*2-5,7-8H,9H2,1H3;2*1-7H;2*1H;;/q4*-1;;;2*+2/p-2