2,4-bis(fluoranyl)-1-isocyano-benzene-3-ide; cyclopenta-1,3-diene; titanium(4+)

Systemtic Name: 2,4-bis(fluoranyl)-1-isocyano-benzene-3-ide; cyclopenta-1,3-diene; titanium(4+) Openeye Name: cyclopenta-1,3-diene; 2,4-difluoro-1-isocyano-benzene-3-ide; titanium(4+) CAS Name: cyclopenta-1,3-diene; 2,4-difluoro-1-isocyanobenzene-3-ide; titanium(4+) IUPAC Name: cyclopenta-1,3-diene; 2,4-difluoro-1-isocyanobenzene-3-ide; titanium(4+) Traditional Name: cyclopenta-1,3-diene; 2,4-difluoro-1-isocyano-benzene-3-ide; titanium(4+) Formula: C24H14F4N2Ti MolecularWeight: 454.241973

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C7H2F2N.2C5H5.Ti/c2*1-10-7-3-2-5(8)4-6(7)9;2*1-2-4-5-3-1;/h2*2-3H;2*1-3H,4H2;/q4*-1;+4