bis(3,5-ditert-butyl-2-oxidanyl-phenyl)azanide; gallium

Systemtic Name: bis(3,5-ditert-butyl-2-oxidanyl-phenyl)azanide; gallium Openeye Name: bis(3,5-ditert-butyl-2-hydroxy-phenyl)azanide; gallium CAS Name: bis(3,5-ditert-butyl-2-hydroxyphenyl)azanide; gallium IUPAC Name: bis(3,5-ditert-butyl-2-hydroxyphenyl)azanide; gallium Traditional Name: bis(3,5-ditert-butyl-2-hydroxy-phenyl)azanide; gallium Formula: C56H84GaN2O4-2 MolecularWeight: 919.00016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1)[N-]C2=CC(=CC(=C2O)C(C)(C)C)C(C)(C)C)O)C(C)(C)C.CC(C)(C)C1=CC(=C(C(=C1)[N-]C2=CC(=CC(=C2O)C(C)(C)C)C(C)(C)C)O)C(C)(C)C.[Ga]

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1)[N-]C2=CC(=CC(=C2O)C(C)(C)C)C(C)(C)C)O)C(C)(C)C.CC(C)(C)C1=CC(=C(C(=C1)[N-]C2=CC(=CC(=C2O)C(C)(C)C)C(C)(C)C)O)C(C)(C)C.[Ga]

InChI

InChI=1S/2C28H42NO2.Ga/c2*1-25(2,3)17-13-19(27(7,8)9)23(30)21(15-17)29-22-16-18(26(4,5)6)14-20(24(22)31)28(10,11)12;/h2*13-16,30-31H,1-12H3;/q2*-1;