hafnium(4+); methanidylbenzene; (1-methanidyl-6-phenyl-pyridin-1-ium-2-yl)methyl-(2,4,6-trimethylphenyl)azanide

Systemtic Name: hafnium(4+); methanidylbenzene; (1-methanidyl-6-phenyl-pyridin-1-ium-2-yl)methyl-(2,4,6-trimethylphenyl)azanide Openeye Name: hafnium(4+); methanidylbenzene; (1-methanidyl-6-phenyl-pyridin-1-ium-2-yl)methyl-(2,4,6-trimethylphenyl)azanide CAS Name: hafnium(4+); methanidylbenzene; (1-methanidyl-6-phenyl-2-pyridin-1-iumyl)methyl-(2,4,6-trimethylphenyl)azanide IUPAC Name: hafnium(4+); methanidylbenzene; (1-methanidyl-6-phenylpyridin-1-ium-2-yl)methyl-(2,4,6-trimethylphenyl)azanide Traditional Name: hafnium(4+); mesityl-[(1-methanidyl-6-phenyl-pyridin-1-ium-2-yl)methyl]azanide; methanidylbenzene Formula: C43H44HfN2 MolecularWeight: 767.31286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)[N-]CC2=CC=CC(=[N+]2[CH2-])C3=CC=CC=C3)C.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[Hf+4]

Isomeric SMILES

CC1=CC(=C(C(=C1)C)[N-]CC2=CC=CC(=[N+]2[CH2-])C3=CC=CC=C3)C.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[Hf+4]

InChI

InChI=1S/C22H23N2.3C7H7.Hf/c1-16-13-17(2)22(18(3)14-16)23-15-20-11-8-12-21(24(20)4)19-9-6-5-7-10-19;3*1-7-5-3-2-4-6-7;/h5-14H,4,15H2,1-3H3;3*2-6H,1H2;/q4*-1;+4