benzene; carbanide; cyclopenta-1,3-diene; titanium(4+)

Systemtic Name: benzene; carbanide; cyclopenta-1,3-diene; titanium(4+) Openeye Name: benzene; carbanide; cyclopenta-1,3-diene; titanium(4+) CAS Name: benzene; carbanide; cyclopenta-1,3-diene; titanium(4+) IUPAC Name: benzene; carbanide; cyclopenta-1,3-diene; titanium(4+) Traditional Name: benzene; carbanide; cyclopenta-1,3-diene; titanium(4+) Formula: C34H36Ti2 MolecularWeight: 540.38364

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Descriptors Computed from Structure

Canonical SMILES:

[CH3-].[CH3-].C1C=CC=[C-]1.C1C=CC=[C-]1.C1C=CC=[C-]1.C1C=CC=[C-]1.C1=CC=[C-]C=C1.C1=CC=[C-]C=C1.[Ti+4].[Ti+4]

Isomeric SMILES

[CH3-].[CH3-].C1C=CC=[C-]1.C1C=CC=[C-]1.C1C=CC=[C-]1.C1C=CC=[C-]1.C1=CC=[C-]C=C1.C1=CC=[C-]C=C1.[Ti+4].[Ti+4]

InChI

InChI=1S/2C6H5.4C5H5.2CH3.2Ti/c2*1-2-4-6-5-3-1;4*1-2-4-5-3-1;;;;/h2*1-5H;4*1-3H,4H2;2*1H3;;/q8*-1;2*+4