cyclopenta-1,3-diene; 4-fluoranylbenzoic acid; 1H-inden-1-ide; methylidenetitanium

Systemtic Name: cyclopenta-1,3-diene; 4-fluoranylbenzoic acid; 1H-inden-1-ide; methylidenetitanium Openeye Name: cyclopenta-1,3-diene; 4-fluorobenzoic acid; 1H-inden-1-ide; methylenetitanium CAS Name: cyclopenta-1,3-diene; 4-fluorobenzoic acid; 1H-inden-1-ide; methylenetitanium IUPAC Name: cyclopenta-1,3-diene; 4-fluorobenzoic acid; 1H-inden-1-ide; methylidenetitanium Traditional Name: cyclopenta-1,3-diene; 4-fluorobenzoic acid; 1H-inden-1-ide; methylenetitanium Formula: C29H24F2O4Ti-2 MolecularWeight: 522.362266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=[Ti].C1C=CC=[C-]1.[CH-]1C=CC2=CC=CC=C21.C1=CC(=CC=C1C(=O)O)F.C1=CC(=CC=C1C(=O)O)F

Isomeric SMILES

C=[Ti].C1C=CC=[C-]1.[CH-]1C=CC2=CC=CC=C21.C1=CC(=CC=C1C(=O)O)F.C1=CC(=CC=C1C(=O)O)F

InChI

InChI=1S/C9H7.2C7H5FO2.C5H5.CH2.Ti/c1-2-5-9-7-3-6-8(9)4-1;2*8-6-3-1-5(2-4-6)7(9)10;1-2-4-5-3-1;;/h1-7H;2*1-4H,(H,9,10);1-3H,4H2;1H2;/q-1;;;-1;;