cyclopenta-1,3-diene; 4-fluoranylbenzoic acid; titanium(2+)

Systemtic Name: cyclopenta-1,3-diene; 4-fluoranylbenzoic acid; titanium(2+) Openeye Name: cyclopenta-1,3-diene; 4-fluorobenzoic acid; titanium(2+) CAS Name: cyclopenta-1,3-diene; 4-fluorobenzoic acid; titanium(2+) IUPAC Name: cyclopenta-1,3-diene; 4-fluorobenzoic acid; titanium(2+) Traditional Name: cyclopenta-1,3-diene; 4-fluorobenzoic acid; titanium(2+) Formula: C24H20F2O4Ti MolecularWeight: 458.277006

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C7H5FO2.2C5H5.Ti/c2*8-6-3-1-5(2-4-6)7(9)10;2*1-2-4-5-3-1;/h2*1-4H,(H,9,10);2*1-3H,4H2;/q;;2*-1;+2