4,5-diethylocta-3,5-diene; 2H-inden-2-ide; zirconium

Systemtic Name: 4,5-diethylocta-3,5-diene; 2H-inden-2-ide; zirconium Openeye Name: 4,5-diethylocta-3,5-diene; 2H-inden-2-ide; zirconium CAS Name: 4,5-diethylocta-3,5-diene; 2H-inden-2-ide; zirconium IUPAC Name: 4,5-diethylocta-3,5-diene; 2H-inden-2-ide; zirconium Traditional Name: 4,5-diethylocta-3,5-diene; 2H-inden-2-ide; zirconium Formula: C30H34Zr-4 MolecularWeight: 485.81496

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Descriptors Computed from Structure

Canonical SMILES:

CC[C-]=C(CC)C(=[C-]CC)CC.[CH-]1C=C2C=CC=CC2=C1.[CH-]1C=C2C=CC=CC2=C1.[Zr]

Isomeric SMILES

CC[C-]=C(CC)C(=[C-]CC)CC.[CH-]1C=C2C=CC=CC2=C1.[CH-]1C=C2C=CC=CC2=C1.[Zr]

InChI

InChI=1S/C12H20.2C9H7.Zr/c1-5-9-11(7-3)12(8-4)10-6-2;2*1-2-5-9-7-3-6-8(9)4-1;/h5-8H2,1-4H3;2*1-7H;/q-2;2*-1;