benzene; 1,9-dihydrofluoren-1-ide; zirconium(4+)

Systemtic Name: benzene; 1,9-dihydrofluoren-1-ide; zirconium(4+) Openeye Name: benzene; 1,9-dihydrofluoren-1-ide; zirconium(4+) CAS Name: benzene; 1,9-dihydrofluoren-1-ide; zirconium(4+) IUPAC Name: benzene; 1,9-dihydrofluoren-1-ide; zirconium(4+) Traditional Name: benzene; 1,9-dihydrofluoren-1-ide; zirconium(4+) Formula: C38H28Zr MolecularWeight: 575.85292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C3=C1[C-]=CC=C3.C1C2=CC=CC=C2C3=C1[C-]=CC=C3.C1=CC=[C-]C=C1.C1=CC=[C-]C=C1.[Zr+4]

Isomeric SMILES

C1C2=CC=CC=C2C3=C1[C-]=CC=C3.C1C2=CC=CC=C2C3=C1[C-]=CC=C3.C1=CC=[C-]C=C1.C1=CC=[C-]C=C1.[Zr+4]

InChI

InChI=1S/2C13H9.2C6H5.Zr/c2*1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12;2*1-2-4-6-5-3-1;/h2*1-5,7-8H,9H2;2*1-5H;/q4*-1;+4