cyclopenta-1,3-diene; methanidylbenzene; titanium(4+); zirconium(4+)

Systemtic Name: cyclopenta-1,3-diene; methanidylbenzene; titanium(4+); zirconium(4+) Openeye Name: cyclopenta-1,3-diene; methanidylbenzene; titanium(4+); zirconium(4+) CAS Name: cyclopenta-1,3-diene; methanidylbenzene; titanium(4+); zirconium(4+) IUPAC Name: cyclopenta-1,3-diene; methanidylbenzene; titanium(4+); zirconium(4+) Traditional Name: cyclopenta-1,3-diene; methanidylbenzene; titanium(4+); zirconium(4+) Formula: C52H52TiZr MolecularWeight: 816.06028

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Descriptors Computed from Structure

Canonical SMILES:

[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.C1C=CC=[C-]1.C1C=CC=[C-]1.[Ti+4].[Zr+4]

Isomeric SMILES

[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.C1C=CC=[C-]1.C1C=CC=[C-]1.[Ti+4].[Zr+4]

InChI

InChI=1S/6C7H7.2C5H5.Ti.Zr/c6*1-7-5-3-2-4-6-7;2*1-2-4-5-3-1;;/h6*2-6H,1H2;2*1-3H,4H2;;/q8*-1;2*+4