2-tert-butyl-6-[[2,3,4,5,6-pentakis(fluoranyl)phenyl]iminomethyl]phenolate; hafnium(4+); methanidylbenzene

Systemtic Name: 2-tert-butyl-6-[[2,3,4,5,6-pentakis(fluoranyl)phenyl]iminomethyl]phenolate; hafnium(4+); methanidylbenzene Openeye Name: 2-tert-butyl-6-[(2,3,4,5,6-pentafluorophenyl)iminomethyl]phenolate; hafnium(4+); methanidylbenzene CAS Name: 2-tert-butyl-6-[(2,3,4,5,6-pentafluorophenyl)iminomethyl]phenolate; hafnium(4+); methanidylbenzene IUPAC Name: 2-tert-butyl-6-[(2,3,4,5,6-pentafluorophenyl)iminomethyl]phenolate; hafnium(4+); methanidylbenzene Traditional Name: 2-tert-butyl-6-[(2,3,4,5,6-pentafluorophenyl)iminomethyl]phenolate; hafnium(4+); methanidylbenzene Formula: C48H40F10HfN2O2 MolecularWeight: 1045.317432

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC(=C1[O-])C=NC2=C(C(=C(C(=C2F)F)F)F)F.CC(C)(C)C1=CC=CC(=C1[O-])C=NC2=C(C(=C(C(=C2F)F)F)F)F.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[Hf+4]

Isomeric SMILES

CC(C)(C)C1=CC=CC(=C1[O-])C=NC2=C(C(=C(C(=C2F)F)F)F)F.CC(C)(C)C1=CC=CC(=C1[O-])C=NC2=C(C(=C(C(=C2F)F)F)F)F.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[Hf+4]

InChI

InChI=1S/2C17H14F5NO.2C7H7.Hf/c2*1-17(2,3)9-6-4-5-8(16(9)24)7-23-15-13(21)11(19)10(18)12(20)14(15)22;2*1-7-5-3-2-4-6-7;/h2*4-7,24H,1-3H3;2*2-6H,1H2;/q;;2*-1;+4/p-2