3,5-diphenyl-2H-1,2,3,4-tetrazol-3-ium dichloride

Systemtic Name: 3,5-diphenyl-2H-1,2,3,4-tetrazol-3-ium dichloride Openeye Name: 3,5-diphenyl-2H-tetrazol-3-ium dichloride CAS Name: 3,5-diphenyl-2H-tetrazol-3-ium dichloride IUPAC Name: 3,5-diphenyl-2H-tetrazol-3-ium dichloride Traditional Name: 3,5-diphenyl-2H-tetrazol-3-ium dichloride Formula: C26H22Cl2N8 MolecularWeight: 517.41248

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN[N+](=N2)C3=CC=CC=C3.C1=CC=C(C=C1)C2=NN[N+](=N2)C3=CC=CC=C3.[Cl-].[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NN[N+](=N2)C3=CC=CC=C3.C1=CC=C(C=C1)C2=NN[N+](=N2)C3=CC=CC=C3.[Cl-].[Cl-]

InChI

InChI=1S/2C13H10N4.2ClH/c2*1-3-7-11(8-4-1)13-14-16-17(15-13)12-9-5-2-6-10-12;;/h2*1-10H;2*1H