cyclopenta-1,3-diene; 2,6-ditert-butyl-4-methoxy-phenol; titanium; difluoride

Systemtic Name: cyclopenta-1,3-diene; 2,6-ditert-butyl-4-methoxy-phenol; titanium; difluoride Openeye Name: cyclopenta-1,3-diene; 2,6-ditert-butyl-4-methoxy-phenol; titanium; difluoride CAS Name: cyclopenta-1,3-diene; 2,6-ditert-butyl-4-methoxyphenol; titanium; difluoride IUPAC Name: cyclopenta-1,3-diene; 2,6-ditert-butyl-4-methoxyphenol; titanium; difluoride Traditional Name: cyclopenta-1,3-diene; 2,6-ditert-butyl-4-methoxy-phenol; titanium; difluoride Formula: C20H29F2O2Ti-3 MolecularWeight: 387.306866

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)OC.C1C=CC=[C-]1.[F-].[F-].[Ti]

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)OC.C1C=CC=[C-]1.[F-].[F-].[Ti]

InChI

InChI=1S/C15H24O2.C5H5.2FH.Ti/c1-14(2,3)11-8-10(17-7)9-12(13(11)16)15(4,5)6;1-2-4-5-3-1;;;/h8-9,16H,1-7H3;1-3H,4H2;2*1H;/q;-1;;;/p-2