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Crystal structure of 2(10),2(20)-bis(2,6-dichlorophenyl)-4,7,12,15-tetraoxa-2(5,15)-nickel(II)porpyhrina-1,3(1,2)-dibenzena-cycloheptadecaphane-9-yne dichloromethane monosolvate
The asymmetric unit of the title compound, [Ni(C(52)H(34)Cl(4)N(4)O(4))]·CH(2)Cl(2), consists of two discrete complexes, which show significant differences in the conformation of the side chain. Each Ni(II) cation is coordinated by four nitrogen atoms of a porphyrin molecule within a square-planar...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2019
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6658935/ https://www.ncbi.nlm.nih.gov/pubmed/31391996 http://dx.doi.org/10.1107/S2056989019007527 |
Sumario: | The asymmetric unit of the title compound, [Ni(C(52)H(34)Cl(4)N(4)O(4))]·CH(2)Cl(2), consists of two discrete complexes, which show significant differences in the conformation of the side chain. Each Ni(II) cation is coordinated by four nitrogen atoms of a porphyrin molecule within a square-planar coordination environment. Weak intramolecular C—H⋯Cl and C—H⋯O interactions stabilize the molecular conformation. In the crystal structure, discrete complexes are linked by C—H⋯Cl hydrogen-bonding interactions. In addition, the two unique dichloromethane solvate molecules (one being disordered) are hydrogen-bonded to the Cl atoms of the chlorophenyl groups of the porphyrin molecules, thus stabilizing the three-dimensional arrangement. The crystal exhibits pseudo-orthorhombic metrics, but structure refinements clearly show that the crystal system is monoclinic and that the crystal is twinned by pseudo-merohedry. |
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