Diaquabis(4-formylbenzoato-κO1)bis-(nicotinamide-κN1)cobalt(II)
  
Yazarlar (4)
Doç. Dr. Mustafa SERTÇELİK Kafkas Üniversitesi, Türkiye
Nagihan Aylakdeliba Sakarya Üniversitesi, Türkiye
Prof. Dr. Hacali NECEFOĞLU Kafkas Üniversitesi, Türkiye
Tuncer Hökelek
Hacettepe Üniversitesi, Türkiye
Makale Türü Açık Erişim Özgün Makale (ESCI dergilerinde yayınlanan tam makale)
Dergi Adı Acta Crystallographica Section E Structure Reports Online
Dergi ISSN 1600-5368
Makale Dili İngilizce Basım Tarihi 08-2012
Cilt / Sayı / Sayfa 68 / 8 / – DOI 10.1107/S1600536812032205
Makale Linki https://journals.iucr.org/e/issues/2012/08/00/xu5597/xu5597.pdf
Özet
In the title complex, [Co(C8H5O3) 2(C6H6N2O)2(H 2O)2], the CoII cation is located on an inversion center and is coordinated by two 4-formyl-benzoate (FB) anions, two nicotinamide (NA) ligands and two water mol-ecules. The four O atoms in the equatorial plane around the CoII cation form a slightly distorted square-planar arrangement, while the slightly distorted octa-hedral coordination is completed by the two N atoms of the NA ligands in the axial positions. The dihedral angle between the carboxyl-ate group and the adjacent benzene ring is 23.91 (9)°, while the pyridine and benzene rings are oriented at a dihedral angle of 88.84 (4)°. The coordinating water mol-ecule links with the carboxyl-ate group via an intra-molecular O-H⋯O hydrogen bond. In the crystal, N-H⋯O, O-H⋯O and weak C-H⋯O hydrogen bonds link the mol-ecules into a three-dimensional supra-molecular network. π-π stacking between the parallel benzene rings of adjacent mol-ecules [centroid-centroid distance = 3.8505 (8) Å] may further stabilize the structure. A weak C-H⋯π inter-action also occurs in the crystal.
Anahtar Kelimeler
data-to-parameter ratio = 16.3 | mean σ(C-C) = 0.002 Å | R factor = 0.026 | single-crystal X-ray study | T = 100 K | wR factor = 0.069