cyclopenta-1,4-dien-1-ylmethylcyclohexane; methanidylbenzene; zirconium(4+)

Systemtic Name: cyclopenta-1,4-dien-1-ylmethylcyclohexane; methanidylbenzene; zirconium(4+) Openeye Name: cyclopenta-1,4-dien-1-ylmethylcyclohexane; methanidylbenzene; zirconium(4+) CAS Name: 1-cyclopenta-1,4-dienylmethylcyclohexane; methanidylbenzene; zirconium(4+) IUPAC Name: cyclopenta-1,4-dien-1-ylmethylcyclohexane; methanidylbenzene; zirconium(4+) Traditional Name: cyclopenta-1,4-dien-1-ylmethylcyclohexane; methanidylbenzene; zirconium(4+) Formula: C38H48Zr MolecularWeight: 596.01172

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Descriptors Computed from Structure

Canonical SMILES:

[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.C1CCC(CC1)CC2=[C-]CC=C2.C1CCC(CC1)CC2=[C-]CC=C2.[Zr+4]

Isomeric SMILES

[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.C1CCC(CC1)CC2=[C-]CC=C2.C1CCC(CC1)CC2=[C-]CC=C2.[Zr+4]

InChI

InChI=1S/2C12H17.2C7H7.Zr/c2*1-2-6-11(7-3-1)10-12-8-4-5-9-12;2*1-7-5-3-2-4-6-7;/h2*4,8,11H,1-3,5-7,10H2;2*2-6H,1H2;/q4*-1;+4