2,4-bis(fluoranyl)phenolate; cyclopenta-1,3-diene; titanium(4+)

Systemtic Name: 2,4-bis(fluoranyl)phenolate; cyclopenta-1,3-diene; titanium(4+) Openeye Name: cyclopenta-1,3-diene; 2,4-difluorophenolate; titanium(4+) CAS Name: cyclopenta-1,3-diene; 2,4-difluorophenolate; titanium(4+) IUPAC Name: cyclopenta-1,3-diene; 2,4-difluorophenolate; titanium(4+) Traditional Name: cyclopenta-1,3-diene; 2,4-difluorophenolate; titanium(4+) Formula: C22H16F4O2Ti MolecularWeight: 436.221853

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C=CC=[C-]1.C1C=CC=[C-]1.C1=CC(=C(C=C1F)F)[O-].C1=CC(=C(C=C1F)F)[O-].[Ti+4]

Isomeric SMILES

C1C=CC=[C-]1.C1C=CC=[C-]1.C1=CC(=C(C=C1F)F)[O-].C1=CC(=C(C=C1F)F)[O-].[Ti+4]

InChI

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