2,6-bis(fluoranyl)phenol; cyclopenta-1,3-diene; zirconium(2+)

Systemtic Name: 2,6-bis(fluoranyl)phenol; cyclopenta-1,3-diene; zirconium(2+) Openeye Name: cyclopenta-1,3-diene; 2,6-difluorophenol; zirconium(2+) CAS Name: cyclopenta-1,3-diene; 2,6-difluorophenol; zirconium(2+) IUPAC Name: cyclopenta-1,3-diene; 2,6-difluorophenol; zirconium(2+) Traditional Name: cyclopenta-1,3-diene; 2,6-difluorophenol; zirconium(2+) Formula: C22H18F4O2Zr MolecularWeight: 481.594733

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C=CC=[C-]1.C1C=CC=[C-]1.C1=CC(=C(C(=C1)F)O)F.C1=CC(=C(C(=C1)F)O)F.[Zr+2]

Isomeric SMILES

C1C=CC=[C-]1.C1C=CC=[C-]1.C1=CC(=C(C(=C1)F)O)F.C1=CC(=C(C(=C1)F)O)F.[Zr+2]

InChI

InChI=1S/2C6H4F2O.2C5H5.Zr/c2*7-4-2-1-3-5(8)6(4)9;2*1-2-4-5-3-1;/h2*1-3,9H;2*1-3H,4H2;/q;;2*-1;+2