(2-cyclopenta-1,4-dien-1-ylcyclopenta-1,4-dien-1-yl)methylcyclohexane; methanidylbenzene; zirconium(3+)

Systemtic Name: (2-cyclopenta-1,4-dien-1-ylcyclopenta-1,4-dien-1-yl)methylcyclohexane; methanidylbenzene; zirconium(3+) Openeye Name: (2-cyclopenta-1,4-dien-1-ylcyclopenta-1,4-dien-1-yl)methylcyclohexane; methanidylbenzene; zirconium(3+) CAS Name: [2-(1-cyclopenta-1,4-dienyl)-1-cyclopenta-1,4-dienyl]methylcyclohexane; methanidylbenzene; zirconium(3+) IUPAC Name: (2-cyclopenta-1,4-dien-1-ylcyclopenta-1,4-dien-1-yl)methylcyclohexane; methanidylbenzene; zirconium(3+) Traditional Name: (2-cyclopenta-1,4-dien-1-ylcyclopenta-1,4-dien-1-yl)methylcyclohexane; methanidylbenzene; zirconium(3+) Formula: C31H35Zr MolecularWeight: 498.8336

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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)C3=[C-]CC=C3.[Zr+3]

Isomeric SMILES

[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.C1CCC(CC1)CC2=C(CC=C2)C3=[C-]CC=C3.[Zr+3]

InChI

InChI=1S/C17H21.2C7H7.Zr/c1-2-7-14(8-3-1)13-16-11-6-12-17(16)15-9-4-5-10-15;2*1-7-5-3-2-4-6-7;/h4,6,9,11,14H,1-3,5,7-8,12-13H2;2*2-6H,1H2;/q3*-1;+3