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

Systemtic Name: cyclopenta-1,3-diene; methanidylbenzene; zirconium(4+) Openeye Name: cyclopenta-1,3-diene; methanidylbenzene; zirconium(4+) CAS Name: cyclopenta-1,3-diene; methanidylbenzene; zirconium(4+) IUPAC Name: cyclopenta-1,3-diene; methanidylbenzene; zirconium(4+) Traditional Name: cyclopenta-1,3-diene; methanidylbenzene; zirconium(4+) Formula: C26H26Zr MolecularWeight: 429.70864

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

Isomeric SMILES

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

InChI

InChI=1S/3C7H7.C5H5.Zr/c3*1-7-5-3-2-4-6-7;1-2-4-5-3-1;/h3*2-6H,1H2;1-3H,4H2;/q4*-1;+4