naphthalene-1,2-diolate; nickel(2+); [2-phenyl-3-[(E)-2-phenylethenyl]azirin-1-ium-1-ylidene]azanide

Systemtic Name: naphthalene-1,2-diolate; nickel(2+); [2-phenyl-3-[(E)-2-phenylethenyl]azirin-1-ium-1-ylidene]azanide Openeye Name: nickelous; naphthalene-1,2-diolate; [2-phenyl-3-[(E)-styryl]azirin-1-ium-1-ylidene]azanide CAS Name: naphthalene-1,2-diolate; nickel(2+); [2-phenyl-3-[(E)-2-phenylethenyl]-1-azirin-1-iumylidene]azanide IUPAC Name: naphthalene-1,2-diolate; nickel(2+); [2-phenyl-3-[(E)-2-phenylethenyl]azirin-1-ium-1-ylidene]azanide Traditional Name: nickelous; naphthalene-1,2-diolate; [2-phenyl-3-[(E)-styryl]azirin-1-ium-1-ylidene]azanide Formula: C26H18N2NiO2 MolecularWeight: 449.12672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC2=C([N+]2=[N-])C3=CC=CC=C3.C1=CC=C2C(=C1)C=CC(=C2[O-])[O-].[Ni+2]

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C2=C([N+]2=[N-])C3=CC=CC=C3.C1=CC=C2C(=C1)C=CC(=C2[O-])[O-].[Ni+2]

InChI

InChI=1S/C16H12N2.C10H8O2.Ni/c17-18-15(12-11-13-7-3-1-4-8-13)16(18)14-9-5-2-6-10-14;11-9-6-5-7-3-1-2-4-8(7)10(9)12;/h1-12H;1-6,11-12H;/q;;+2/p-2/b12-11+;;