bis(1,3-diphenyl-1,2,3,4-tetrazol-1-ium-5-yl)azanide tetrafluoroborate

Systemtic Name: bis(1,3-diphenyl-1,2,3,4-tetrazol-1-ium-5-yl)azanide tetrafluoroborate Openeye Name: bis(1,3-diphenyltetrazol-1-ium-5-yl)azanide tetrafluoroborate CAS Name: bis(1,3-diphenyl-5-tetrazol-1-iumyl)azanide tetrafluoroborate IUPAC Name: bis(1,3-diphenyltetrazol-1-ium-5-yl)azanide tetrafluoroborate Traditional Name: bis(1,3-diphenyltetrazol-1-ium-5-yl)azanide tetrafluoroborate Formula: C26H20BF4N9 MolecularWeight: 545.301913

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.C1=CC=C(C=C1)N2N=C([N+](=N2)C3=CC=CC=C3)[N-]C4=NN(N=[N+]4C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

[B-](F)(F)(F)F.C1=CC=C(C=C1)N2N=C([N+](=N2)C3=CC=CC=C3)[N-]C4=NN(N=[N+]4C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C26H20N9.BF4/c1-5-13-21(14-6-1)32-25(28-34(30-32)23-17-9-3-10-18-23)27-26-29-35(24-19-11-4-12-20-24)31-33(26)22-15-7-2-8-16-22;2-1(3,4)5/h1-20H;/q+1;-1