(2E)-3,4-dimethylhexa-2,4-diene; 4-phenyl-1H-inden-1-ide; zirconium(2+)

Systemtic Name: (2E)-3,4-dimethylhexa-2,4-diene; 4-phenyl-1H-inden-1-ide; zirconium(2+) Openeye Name: (2E)-3,4-dimethylhexa-2,4-diene; 4-phenyl-1H-inden-1-ide; zirconium(2+) CAS Name: (2E)-3,4-dimethylhexa-2,4-diene; 4-phenyl-1H-inden-1-ide; zirconium(2+) IUPAC Name: (2E)-3,4-dimethylhexa-2,4-diene; 4-phenyl-1H-inden-1-ide; zirconium(2+) Traditional Name: (2E)-3,4-dimethylhexa-2,4-diene; 4-phenyl-1H-inden-1-ide; zirconium(2+) Formula: C23H24Zr MolecularWeight: 391.66066

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C)C(=[C-]C)C.[CH-]1C=CC2=C1C=CC=C2C3=CC=CC=C3.[Zr+2]

Isomeric SMILES

C/C=C(\C)/C(=[C-]C)C.[CH-]1C=CC2=C1C=CC=C2C3=CC=CC=C3.[Zr+2]

InChI

InChI=1S/C15H11.C8H13.Zr/c1-2-6-12(7-3-1)14-10-4-8-13-9-5-11-15(13)14;1-5-7(3)8(4)6-2;/h1-11H;5H,1-4H3;/q2*-1;+2/b;7-5+;