Diaquabis(4-formylbenzoato-kappa O-1)bis-(nicotinamide-kappa N-1)cobalt(II)

被引:3
作者
Sertcelik, Mustafa [1 ]
Delibas, Nagihan Caylak [2 ]
Necefoglu, Hacali [1 ]
Hokelek, Tuncer [3 ]
机构
[1] Kafkas Univ, Dept Chem, TR-36100 Kars, Turkey
[2] Sakarya Univ, Dept Phys, TR-54187 Sakarya, Turkey
[3] Hacettepe Univ, Dept Phys, TR-06800 Ankara, Turkey
关键词
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;
D O I
10.1107/S1600536812032205
中图分类号
O7 [晶体学];
学科分类号
0702 ; 070205 ; 0703 ; 080501 ;
摘要
In the title complex, [Co(C8H5O3)(2)(C6H6N2O)(2)(H2O)(2)], the Co II cation is located on an inversion center and is coordinated by two 4-formylbenzoate (FB) anions, two nicotinamide (NA) ligands and two water molecules. The four O atoms in the equatorial plane around the Co II cation form a slightly distorted square-planar arrangement, while the slightly distorted octahedral coordination is completed by the two N atoms of the NA ligands in the axial positions. The dihedral angle between the carboxylate group and the adjacent benzene ring is 23.91 (9)degrees, while the pyridine and benzene rings are oriented at a dihedral angle of 88.84 (4)degrees The coordinating water molecule links with the carboxylate group via an intramolecular O-H center dot center dot center dot O hydrogen bond. In the crystal, N-H center dot center dot center dot O, O-H center dot center dot center dot O and weak C-H center dot center dot center dot O hydrogen bonds link the molecules into a three-dimensional supramolecular network. pi-pi stacking between the parallel benzene rings of adjacent molecules [centroid-centroid distance = 3.8505 (8) angstrom] may further stabilize the structure. A weak C-H center dot center dot center dot pi interaction also occurs in the crystal.
引用
收藏
页码:M1091 / +
页数:8
相关论文
共 19 条
[1]   TABLES OF BOND LENGTHS DETERMINED BY X-RAY AND NEUTRON-DIFFRACTION .1. BOND LENGTHS IN ORGANIC-COMPOUNDS [J].
ALLEN, FH ;
KENNARD, O ;
WATSON, DG ;
BRAMMER, L ;
ORPEN, AG ;
TAYLOR, R .
JOURNAL OF THE CHEMICAL SOCIETY-PERKIN TRANSACTIONS 2, 1987, (12) :S1-S19
[2]  
[Anonymous], 2005, SADABS
[3]   Diaquabis(2-iodobenzoato-kO)bis-(nicotinamide-kN(1))cobalt(II) [J].
Aydin, Omur ;
Delibas, Nagihan Caylak ;
Necefoglu, Hacali ;
Hokelek, Tuncer .
ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS, 2012, 68 :M521-+
[4]   CRYSTAL AND MOLECULAR STRUCTURE OF MONO-(N,N-DIETHYLNICOTINAMIDE)CADMIUM DITHIOCIOCYANATE [J].
BIGOLI, F ;
BRAIBANTI, A ;
TIRIPICCHIO, A ;
PELLINGHELLI, MA .
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL CRYSTALLOGRAPHY AND CRYSTAL CHEMISTRY, 1972, B 28 (MAR15) :962-+
[5]  
Bruker, 2007, APEX2 SAINT
[6]  
Farrugia L.J., 1997, J APPL CRYSTALLOGR, V30, P565, DOI [DOI 10.1107/S0021889897003117, 10.1107/S0021889897003117]
[7]  
Farrugia L.J., 1999, J APPL CRYSTALLOGR, V32, P837, DOI [10.1107/S0021889812029111, DOI 10.1107/S0021889812029111]
[8]   Diaquabis(2-chlorobenzoato-κO)bis(nicotinamide-κN1)nickel(II) [J].
Hoekelek, Tuncer ;
Dal, Hakan ;
Tercan, Baris ;
Oezbek, F. Elif ;
Necefoglu, Hacali .
ACTA CRYSTALLOGRAPHICA SECTION E-STRUCTURE REPORTS ONLINE, 2009, 65 :M466-U1104
[9]   trans-diaquabis(nicotinamide-N′-)bis(4-nitrobenzoato-O)cobalt(II) [J].
Hokelek, T ;
Necefoglu, H .
ACTA CRYSTALLOGRAPHICA SECTION C-CRYSTAL STRUCTURE COMMUNICATIONS, 1998, 54 :1242-1244
[10]   trans-Bis(benzoato-O,O')bis(N,N-diethylnicotinamide-N-1)copper(II) [J].
Hokelek, T ;
Gunduz, H ;
Necefoglu, H .
ACTA CRYSTALLOGRAPHICA SECTION C-CRYSTAL STRUCTURE COMMUNICATIONS, 1996, 52 :2470-2473