2,7-dimethyl-9H-fluoren-9-ide; methanesulfonate; zirconium(2+)

Systemtic Name: 2,7-dimethyl-9H-fluoren-9-ide; methanesulfonate; zirconium(2+) Openeye Name: 2,7-dimethyl-9H-fluoren-9-ide; methanesulfonate; zirconium(2+) CAS Name: 2,7-dimethyl-9H-fluoren-9-ide; methanesulfonate; zirconium(2+) IUPAC Name: 2,7-dimethyl-9H-fluoren-9-ide; methanesulfonate; zirconium(2+) Traditional Name: 2,7-dimethyl-9H-fluoren-9-ide; zirconium(2+); dimesylate Formula: C32H32O6S2Zr2 MolecularWeight: 759.17088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C3=C([CH-]2)C=C(C=C3)C.CC1=CC2=C(C=C1)C3=C([CH-]2)C=C(C=C3)C.CS(=O)(=O)[O-].CS(=O)(=O)[O-].[Zr+2].[Zr+2]

Isomeric SMILES

CC1=CC2=C(C=C1)C3=C([CH-]2)C=C(C=C3)C.CC1=CC2=C(C=C1)C3=C([CH-]2)C=C(C=C3)C.CS(=O)(=O)[O-].CS(=O)(=O)[O-].[Zr+2].[Zr+2]

InChI

InChI=1S/2C15H13.2CH4O3S.2Zr/c2*1-10-3-5-14-12(7-10)9-13-8-11(2)4-6-15(13)14;2*1-5(2,3)4;;/h2*3-9H,1-2H3;2*1H3,(H,2,3,4);;/q2*-1;;;2*+2/p-2