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Crystal structure of cis-dichlorido(1,4,8,11-tetraazacyclotetradecane-κ(4) N)chromium(III) (oxalato-κ(2) O (1),O (2))(1,4,8,11-tetraazacyclotetradecane-κ(4) N)chromium(III) bis(perchlorate) from synchrotron data
In the asymmetric unit of the title compound, [CrCl(2)(C(10)H(24)N(4))][Cr(C(2)O(4))(C(10)H(24)N(4))](ClO(4))(2) (C(10)H(24)N(4) = 1,4,8,11-tetraazacyclotetradecane, cyclam; C(2)O(4) = oxalate, ox), there are two independent halves of the [CrCl(2)(cyclam)](+) and [Cr(ox)(cyclam)](+) cations, and...
Autores principales: | , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2016
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5050767/ https://www.ncbi.nlm.nih.gov/pubmed/27746932 http://dx.doi.org/10.1107/S2056989016014134 |
Sumario: | In the asymmetric unit of the title compound, [CrCl(2)(C(10)H(24)N(4))][Cr(C(2)O(4))(C(10)H(24)N(4))](ClO(4))(2) (C(10)H(24)N(4) = 1,4,8,11-tetraazacyclotetradecane, cyclam; C(2)O(4) = oxalate, ox), there are two independent halves of the [CrCl(2)(cyclam)](+) and [Cr(ox)(cyclam)](+) cations, and one perchlorate anion. In the complex cations, which are completed by application of twofold rotation symmetry, the Cr(III) ions are coordinated by the four N atoms of a cyclam ligand, and by two chloride ions or one oxalate bidentate ligand in a cis arrangement, displaying an overall distorted octahedral coordination environment. The Cr—N(cyclam) bond lengths are in the range of 2.075 (5) to 2.096 (4) Å while the Cr—Cl and Cr—O(ox) bond lengths are 2.3358 (14) and 1.956 (4) Å, respectively. Both cyclam moieties adopt the cis-V conformation. The slightly distorted tetrahedral ClO(4) (−) anion remains outside the coordination sphere. The supramolecular architecture includes N—H⋯O and N—H⋯Cl hydrogen bonding between cyclam NH donor groups, O atoms of the oxalate ligand or ClO(4) (−) anions and one Cl ligand as acceptors, leading to a three-dimensional network structure. |
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