1-[bis(3-phenylpyrazol-1-yl)methyl]-3-phenyl-pyrazole; buta-1,3-diene; manganese(2+)

Systemtic Name: 1-[bis(3-phenylpyrazol-1-yl)methyl]-3-phenyl-pyrazole; buta-1,3-diene; manganese(2+) Openeye Name: manganous; 1-[bis(3-phenylpyrazol-1-yl)methyl]-3-phenyl-pyrazole; buta-1,3-diene CAS Name: 1-[bis(3-phenyl-1-pyrazolyl)methyl]-3-phenylpyrazole; buta-1,3-diene; manganese(2+) IUPAC Name: 1-[bis(3-phenylpyrazol-1-yl)methyl]-3-phenylpyrazole; buta-1,3-diene; manganese(2+) Traditional Name: manganous; 1-[bis(3-phenylpyrazol-1-yl)methyl]-3-phenyl-pyrazole; buta-1,3-diene Formula: C32H28MnN6+2 MolecularWeight: 551.542969

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Descriptors Computed from Structure

Canonical SMILES:

C=CC=C.C1=CC=C(C=C1)C2=NN(C=C2)C(N3C=CC(=N3)C4=CC=CC=C4)N5C=CC(=N5)C6=CC=CC=C6.[Mn+2]

Isomeric SMILES

C=CC=C.C1=CC=C(C=C1)C2=NN(C=C2)C(N3C=CC(=N3)C4=CC=CC=C4)N5C=CC(=N5)C6=CC=CC=C6.[Mn+2]

InChI

InChI=1S/C28H22N6.C4H6.Mn/c1-4-10-22(11-5-1)25-16-19-32(29-25)28(33-20-17-26(30-33)23-12-6-2-7-13-23)34-21-18-27(31-34)24-14-8-3-9-15-24;1-3-4-2;/h1-21,28H;3-4H,1-2H2;/q;;+2