2017
DOI: 10.1107/s2056989017011379
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Crystal structure of tetraaquabis(1,3-dimethyl-2,6-dioxo-7H-purin-7-ido-κN7)cobalt(II)

Abstract: 4 ], comprises mononuclear molecules consisting of a Co II ion, two deprotonated theophylline ligands (systematic name: 1,3-dimethyl-7H-purine-2,6-dione) and four coordinating water molecules. The Co II atom lies on an inversion centre and has a slightly distorted octahedral coordination environment, with two N atoms of two trans-oriented theophylline ligands and the O atoms of four water molecules. An intramolecular hydrogen bond stabilizes this conformation. A three-dimensional supramolecular network structu… Show more

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Cited by 8 publications
(3 citation statements)
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“…Theophylline transition metal complexes can serve as model compounds to study the relationship between metal ions and nucleic acid oxo purine bases [18][19][20][21][22]. Theophylline functions as a monodentate ligand in a neutral or fundamental environment and coordinates to metal ions through N7 atom [23][24][25][26][27]. In some instances, it functions as a bidentate N(7)/O(6) chelating ligand or as a bridging ligand with N(7)/O(6) chelation and N(9) coordination simultaneously [28,29].…”
Section: Introductionmentioning
confidence: 99%
“…Theophylline transition metal complexes can serve as model compounds to study the relationship between metal ions and nucleic acid oxo purine bases [18][19][20][21][22]. Theophylline functions as a monodentate ligand in a neutral or fundamental environment and coordinates to metal ions through N7 atom [23][24][25][26][27]. In some instances, it functions as a bidentate N(7)/O(6) chelating ligand or as a bridging ligand with N(7)/O(6) chelation and N(9) coordination simultaneously [28,29].…”
Section: Introductionmentioning
confidence: 99%
“…Theophylline functions as a monodentate ligand in a neutral or fundamental environment and coordinates metal ions through N 7 atoms [19][20][21]. In some instances, it functions as a bidentate N(7)/O(6) chelating ligand or as a bridging ligand with N(7)/O(6) chelation and N(9) coordination simultaneously [22]. The aim of this study was to report the synthesis and characterization of Zn(II), Mn(II) and Fe(II) nanocomplexes with theophylline as a ligand for antibacterial applications.…”
Section: Introductionmentioning
confidence: 99%
“…In particular, transition metal complexes with drugs have been attracting continuously growing interest [27]. Regrettably, only a limited number of complexes with theophylline have been reported so far [28][29][30][31][32][33][34][35][36]. In most cases, the coordinating atom is N7, while structures that involve N9 and O6 are also described [32,35,36].…”
Section: Introductionmentioning
confidence: 99%