aluminum; [2,6-di(propan-2-yl)phenyl]-[(Z)-pyrrol-2-ylidenemethyl]azanide; methanidylbenzene; methanidylcyclohexane; 1,2,3,4,5-pentakis(fluoranyl)benzene-6-ide; zirconium(4+)

Systemtic Name: aluminum; [2,6-di(propan-2-yl)phenyl]-[(Z)-pyrrol-2-ylidenemethyl]azanide; methanidylbenzene; methanidylcyclohexane; 1,2,3,4,5-pentakis(fluoranyl)benzene-6-ide; zirconium(4+) Openeye Name: aluminum; (2,6-diisopropylphenyl)-[(Z)-pyrrol-2-ylidenemethyl]azanide; methanidylbenzene; methanidylcyclohexane; 1,2,3,4,5-pentafluorobenzene-6-ide; zirconium(4+) CAS Name: aluminum; [2,6-di(propan-2-yl)phenyl]-[(Z)-2-pyrrolylidenemethyl]azanide; methanidylbenzene; methanidylcyclohexane; 1,2,3,4,5-pentafluorobenzene-6-ide; zirconium(4+) IUPAC Name: aluminum; [2,6-di(propan-2-yl)phenyl]-[(Z)-pyrrol-2-ylidenemethyl]azanide; methanidylbenzene; methanidylcyclohexane; 1,2,3,4,5-pentafluorobenzene-6-ide; zirconium(4+) Traditional Name: aluminum; (2,6-diisopropylphenyl)-[(Z)-pyrrol-2-ylidenemethyl]azanide; methanidylbenzene; methanidylcyclohexane; 1,2,3,4,5-pentafluorobenzene-6-ide; zirconium(4+) Formula: C56H42AlF15N2Zr MolecularWeight: 1146.127666

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)[N-]C=C2C=CC=N2.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[CH2-][C]1[CH][CH][CH][CH][CH]1.[C-]1=C(C(=C(C(=C1F)F)F)F)F.[C-]1=C(C(=C(C(=C1F)F)F)F)F.[C-]1=C(C(=C(C(=C1F)F)F)F)F.[Al+3].[Zr+4]

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)[N-]/C=C\2/C=CC=N2.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[CH2-][C]1[CH][CH][CH][CH][CH]1.[C-]1=C(C(=C(C(=C1F)F)F)F)F.[C-]1=C(C(=C(C(=C1F)F)F)F)F.[C-]1=C(C(=C(C(=C1F)F)F)F)F.[Al+3].[Zr+4]

InChI

InChI=1S/C17H21N2.3C7H7.3C6F5.Al.Zr/c1-12(2)15-8-5-9-16(13(3)4)17(15)19-11-14-7-6-10-18-14;3*1-7-5-3-2-4-6-7;3*7-2-1-3(8)5(10)6(11)4(2)9;;/h5-13H,1-4H3;3*2-6H,1H2;;;;;/q7*-1;+3;+4/b14-11-;;;;;;;;