bis(bromanyl)nickel; 1-(diphenylmethyl)-3-(phenylmethyl)benzimidazole

Systemtic Name: bis(bromanyl)nickel; 1-(diphenylmethyl)-3-(phenylmethyl)benzimidazole Openeye Name: 1-benzhydryl-3-benzyl-benzimidazole; dibromonickel CAS Name: dibromonickel; 1-(diphenylmethyl)-3-(phenylmethyl)benzimidazole IUPAC Name: 1-benzhydryl-3-benzylbenzimidazole; dibromonickel Traditional Name: 1-benzhydryl-3-benzyl-benzimidazole; dibromonickel Formula: C54H44Br2N4Ni MolecularWeight: 967.45536

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2[C]N(C3=CC=CC=C32)C(C4=CC=CC=C4)C5=CC=CC=C5.C1=CC=C(C=C1)CN2[C]N(C3=CC=CC=C32)C(C4=CC=CC=C4)C5=CC=CC=C5.[Ni](Br)Br

Isomeric SMILES

C1=CC=C(C=C1)CN2[C]N(C3=CC=CC=C32)C(C4=CC=CC=C4)C5=CC=CC=C5.C1=CC=C(C=C1)CN2[C]N(C3=CC=CC=C32)C(C4=CC=CC=C4)C5=CC=CC=C5.[Ni](Br)Br

InChI

InChI=1S/2C27H22N2.2BrH.Ni/c2*1-4-12-22(13-5-1)20-28-21-29(26-19-11-10-18-25(26)28)27(23-14-6-2-7-15-23)24-16-8-3-9-17-24;;;/h2*1-19,27H,20H2;2*1H;/q;;;;+2/p-2