bis(1-methyl-2,6-diphenyl-pyridin-1-ium-4-yl)diazene ditetrafluoroborate

Systemtic Name: bis(1-methyl-2,6-diphenyl-pyridin-1-ium-4-yl)diazene ditetrafluoroborate Openeye Name: bis(1-methyl-2,6-diphenyl-pyridin-1-ium-4-yl)diazene ditetrafluoroborate CAS Name: bis(1-methyl-2,6-diphenyl-4-pyridin-1-iumyl)diazene ditetrafluoroborate IUPAC Name: bis(1-methyl-2,6-diphenylpyridin-1-ium-4-yl)diazene ditetrafluoroborate Traditional Name: bis(1-methyl-2,6-diphenyl-pyridin-1-ium-4-yl)diazene ditetrafluoroborate Formula: C36H30B2F8N4 MolecularWeight: 692.259426

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.[B-](F)(F)(F)F.C[N+]1=C(C=C(C=C1C2=CC=CC=C2)N=NC3=CC(=[N+](C(=C3)C4=CC=CC=C4)C)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

[B-](F)(F)(F)F.[B-](F)(F)(F)F.C[N+]1=C(C=C(C=C1C2=CC=CC=C2)N=NC3=CC(=[N+](C(=C3)C4=CC=CC=C4)C)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C36H30N4.2BF4/c1-39-33(27-15-7-3-8-16-27)23-31(24-34(39)28-17-9-4-10-18-28)37-38-32-25-35(29-19-11-5-12-20-29)40(2)36(26-32)30-21-13-6-14-22-30;2*2-1(3,4)5/h3-26H,1-2H3;;/q+2;2*-1