10-(2,2-dideuterioethenyl)-5,15-diphenyl-porphyrin-22,24-diide; nickel(2+)

Systemtic Name: 10-(2,2-dideuterioethenyl)-5,15-diphenyl-porphyrin-22,24-diide; nickel(2+) Openeye Name: nickelous 10-(2,2-dideuteriovinyl)-5,15-diphenyl-porphyrin-22,24-diide CAS Name: 10-(2,2-dideuterioethenyl)-5,15-diphenylporphyrin-22,24-diide; nickel(2+) IUPAC Name: 10-(2,2-dideuterioethenyl)-5,15-diphenylporphyrin-22,24-diide; nickel(2+) Traditional Name: nickelous 10-(2,2-dideuteriovinyl)-5,15-diphenyl-porphine-22,24-diide Formula: C34H22N4Ni MolecularWeight: 547.271004

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1=C2C=CC(=N2)C(=C3C=CC(=CC4=NC(=C(C5=CC=C1[N-]5)C6=CC=CC=C6)C=C4)[N-]3)C7=CC=CC=C7.[Ni+2]

Isomeric SMILES

[2H]C(=CC1=C2C=CC(=N2)C(=C3C=CC(=CC4=NC(=C(C5=CC=C1[N-]5)C6=CC=CC=C6)C=C4)[N-]3)C7=CC=CC=C7)[2H].[Ni+2]

InChI

InChI=1S/C34H22N4.Ni/c1-2-26-27-17-19-31(37-27)33(22-9-5-3-6-10-22)29-15-13-24(35-29)21-25-14-16-30(36-25)34(23-11-7-4-8-12-23)32-20-18-28(26)38-32;/h2-21H,1H2;/q-2;+2/i1D2;