scholarly journals Crystal structure oftrans-diaquabis(1H-pyrazole-3-carboxylato-κ2N,O)copper(II) dihydrate

2015 ◽  
Vol 71 (12) ◽  
pp. m232-m233 ◽  
Author(s):  
Santiago Reinoso ◽  
Beñat Artetxe ◽  
Oscar Castillo ◽  
Antonio Luque ◽  
Juan M. Gutiérrez-Zorrilla
Keyword(s):  
Hydrogen Bonds ◽  
Complex Molecule ◽  
Three Dimensional ◽  
Organic Ligands ◽  
Water Molecules ◽  
Coordination Geometry ◽  
Complex Molecules ◽  
Carboxylate Ligands ◽  
Dimensional Network ◽  
Additional Hydrogen

In the title compound, [Cu(C4H3N2O2)2(H2O)2]·2H2O, the CuIIion is located on an inversion centre and exhibits an axially elongated octahedral coordination geometry. The equatorial plane is formed by twoN,O-bidentate 1H-pyrazole-3-carboxylate ligands in atransconfiguration. The axial positions are occupied by two water molecules. The mononuclear complex molecules are arranged in layers parallel to theabplane. Each complex molecule is linked to four adjacent species through intermolecular O—H...O and N—H...O hydrogen bonds that are established between the coordinating water molecules and carboxylate O atoms or protonated N atoms of the organic ligands. These layers are further connected into a three-dimensional network by additional hydrogen bonds involving solvent water molecules and non-coordinating carboxylate O atoms.

scholarly journals Crystal structure of (2-amino-7-methyl-4-oxidopteridine-6-carboxylato-κ3O4,N5,O6)aqua(1,10-phenanthroline-κ2N,N′)zinc trihydrate

2015 ◽  
Vol 71 (9) ◽  
pp. m162-m163
Author(s):  
Siddhartha S. Baisya ◽  
Baidyanath Ghosh ◽  
Parag S. Roy
Keyword(s):  
Hydrogen Bonds ◽  
Three Dimensional ◽  
Carboxylate Ligand ◽  
Water Molecules ◽  
Coordination Geometry ◽  
Complex Molecules ◽  
Distorted Octahedral Coordination ◽  
Dimensional Network ◽  
Distorted Octahedral Coordination Geometry ◽  
Distorted Octahedral

In the title compound, [Zn(C8H5N5O3)(C12H8N2)(H2O)]·3H2O, a tridentate 2-amino-7-methyl-4-oxidopteridine-6-carboxylate ligand, a bidentate ancillary 1,10-phenanthroline (phen) ligand and a water molecule complete a distorted octahedral coordination geometry around the ZnIIatom. The pterin ligand forms two chelate rings. The phen and pterin ring systems are nearly perpendicular [dihedral angle = 85.16 (5)°]. Classical N—H...O, O—H...N and O—H...O hydrogen bonds and weak C—H...O hydrogen bonds link the complex molecules and lattice water molecules into a three-dimensional network. π–π stacking contacts are observed as well, with centroid-to-centroid distances of 3.5679 (14), 3.7004 (14), 3.6641 (15), 3.6974 (13) and 3.3412 (12) Å.

Diaquabis(dicyanamido)bis[4-(2-pyridyl)-4H-1,2,4-triazole-κN 1]cobalt(II)

2006 ◽  
Vol 62 (7) ◽  
pp. m1479-m1481 ◽  
Author(s):  
Yu-Hong Ma ◽  
Pi-Zhuang Ma ◽  
Huan-Qin Zhu ◽  
Chang-Cheng Liu
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonds ◽  
Three Dimensional ◽  
Title Complex ◽  
Water Molecules ◽  
Two Dimensional ◽  
Complex Molecules ◽  
Dimensional Network

The title complex, [Co(C2N3)2(C7H6N4)2(H2O)2] or [Co(dca)2(pytrz)2(H2O)2], where pytrz is 4-(2-pyridyl)-4H-1,2,4-triazole and dca is the dicyanamide monoanion, was prepared using pytrz, Na(dca) and CoCl2·6H2O. The CoII atom lies on a center of inversion and is coordinated in a slightly distorted octahderal geometry by two pytrz ligands, two dca ligands and two trans-oriented water molecules. In the crystal structure, complex molecules are linked by O—H...N hydrogen bonds into a two-dimensional network and further into a three-dimensional network via weak C—H...N hydrogen bonds.

scholarly journals Bis(4′-chloro-2,2′:6′,2′′-terpyridine-κ3 N,N′,N′′)ruthenium(II) dichloride dihydrate

2012 ◽  
Vol 68 (6) ◽  
pp. m777-m778 ◽  
Author(s):  
Ying Wang ◽  
Rui Jiao ◽  
Xiang-Lei Qiu ◽  
Jian Wang ◽  
Wei Huang
Keyword(s):  
Hydrogen Bonds ◽  
Three Dimensional ◽  
Maximum Deviation ◽  
Water Molecules ◽  
Coordination Geometry ◽  
Distorted Octahedral Coordination ◽  
Dimensional Network ◽  
Distorted Octahedral Coordination Geometry ◽  
Distorted Octahedral ◽  
Terpyridine Ligands

In the cation of the title compound, [Ru(C15H10ClN3)2]Cl2·2H2O, the metal atom exhibits a distorted octahedral coordination geometry provided by the N atoms of two tridentate terpyridine ligands. The ligands are approximately planar [maximum deviation = 0.156 (5) Å] and form a dihedral angle of 87.0 (3)°. In the crystal, the cations, anions and water molecules are linked into a three-dimensional network by C—H...Cl, C—H...O and O—H...Cl hydrogen bonds.

scholarly journals Diaquabis(1H-imidazole-4-carboxylato-κ2N3,O)cobalt(II)

2013 ◽  
Vol 69 (2) ◽  
pp. m94-m94 ◽  
Author(s):  
Beñat Artetxe ◽  
Leire San Felices ◽  
Aroa Pache ◽  
Santiago Reinoso ◽  
Juan M. Gutiérrez-Zorrilla
Keyword(s):  
Crystal Packing ◽  
Rotation Axis ◽  
Three Dimensional ◽  
Water Molecules ◽  
Coordination Geometry ◽  
Carboxylate Ligands ◽  
Dimensional Network ◽  
Centroid Distance ◽  
Distorted Octahedral Coordination Geometry ◽  
Distorted Octahedral

The title compound, [Co(C4H3N2O2)2(H2O)2], contains a CoIIcation on a twofold rotation axis, exhibiting a distorted octahedral coordination geometry. The equatorial plane is formed by twoN,O-bidentate 1H-imidazole-4-carboxylate ligands and the axial positions are occupied by water molecules. The crystal packing consists of a three-dimensional network stabilized by O—H...O and N—H...O hydrogen bonds, together with weak π–π interactions [centroid–centroid distance = 3.577 (2) Å] between the imidazole rings.

scholarly journals Crystal structure of poly[[hexaqua-1κ4O,2κ2O-bis(μ3-pyridine-2,4-dicarboxylato-1κO2:2κ2N,O2′;1′κO4)cobalt(II)strontium(II)] dihydrate]

2015 ◽  
Vol 71 (9) ◽  
pp. m167-m168
Author(s):  
Zhaojun Yu ◽  
Peng Jiang ◽  
Yanmei Chen
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonds ◽  
Three Dimensional ◽  
Distorted Octahedral Geometry ◽  
Water Molecules ◽  
Coordination Geometry ◽  
Polymeric Complex ◽  
Solvent Water ◽  
Dimensional Network ◽  
Distorted Octahedral

In the title polymeric complex, {[CoSr(C7H3NO4)2(H2O)6]·2H2O}n, the CoIIion, which is situated on a crystallographic centre of inversion, is six-coordinated by two O atoms and two N atoms from two pyridine-2,4-dicarboxylate (pydc2−) ligands and two terminal water molecules in a slightly distorted octahedral geometry, to form atrans-[Co(pydc)2(H2O)2]2−unit. The SrIIion, situated on aC2axis, is coordinated by four O atoms from four pydc2−ligands and four water molecules. The coordination geometry of the SrIIatom can be best described as a distorted dodecahedron. Each SrIIion bridges four [Co(pydc)2(H2O)2]2−units by four COO−groups of four pydc2−ligands to form a three-dimensional network structure. Two additional solvent water molecules are observed in the crystal structure and are connected to the three-dimensional coordination polymer by O—H...O hydrogen bonds. Further intra- and intermolecular O—H...O hydrogen bonds consolidate the overall structure.

scholarly journals Bis(5-amino-1H-tetrazole-κN4)diaqua(oxalato-κ2O1,O2)cadmium

2013 ◽  
Vol 69 (12) ◽  
pp. m645-m646
Author(s):  
Qian Liang ◽  
Yulin Wang ◽  
Yan Zhao ◽  
Gaojuan Cao
Keyword(s):  
Three Dimensional ◽  
Title Complex ◽  
Water Molecules ◽  
Coordination Geometry ◽  
Complex Molecules ◽  
Distorted Octahedral Coordination ◽  
Dimensional Network ◽  
Oxalate Ligand ◽  
Distorted Octahedral Coordination Geometry ◽  
Distorted Octahedral

In the monomeric title complex, [Cd(C2O4)(CH3N5)2(H2O)2], the CdIIion exhibits a distorted octahedral coordination geometry, with the equatorial plane defined by two O atoms from an oxalate ligand and two N atoms from two 5-amino-1H-tetrazole ligands; the axial sites are occupied by two water molecules, with longer Cd—O bond lengths. An intramolecular N—H...O hydrogen bond occurs. In the crystal, N—H...O as well as O—H...O and O—H...N hydrogen bonds (some of which are bifurcated) link the complex molecules into a three-dimensional network.

scholarly journals Pentaaqua(4,6-dihydroxybenzene-1,3-disulfonato-κO1)zinc pentahydrate

2012 ◽  
Vol 68 (4) ◽  
pp. m492-m493
Author(s):  
Zhi-Biao Zhu ◽  
Shan Gao ◽  
Seik Weng Ng ◽  
Edward R. T. Tiekink
Keyword(s):  
Hydrogen Bonds ◽  
Three Dimensional ◽  
Title Complex ◽  
Water Molecules ◽  
Coordination Geometry ◽  
Lattice Water ◽  
Dimensional Network ◽  
Distorted Octahedral ◽  
Hydroxy Groups

The ZnIIatom in the title complex, [Zn(C6H4O8S2)(H2O)5]·5H2O, is coordinated by five water molecules and an O atom of a 4,6-dihydroxybenzene-1,3-disulfonate dianion. The coordination geometry is distorted octahedral, with the Zn—Osulfonatebond relatively long compared to the Zn—Owaterbonds. The coordinated and lattice water molecules interact with each other and with the hydroxy groups and sulfonate ligand through O—H...O hydrogen bonds, generating a tightly held three-dimensional network.

scholarly journals Crystal structure of bis[(1-ammonio-1-phosphonoethyl)phosphonato]tetraaquacadmium dihydrate: a powder X-ray diffraction study

2015 ◽  
Vol 71 (4) ◽  
pp. 342-345 ◽  
Author(s):  
Mwaffak Rukiah ◽  
Thaer Assaad
Keyword(s):  
Complex Molecule ◽  
Three Dimensional ◽  
Distorted Octahedral Geometry ◽  
Water Molecules ◽  
X Ray Diffraction ◽  
Complex Molecules ◽  
Lattice Water ◽  
Dimensional Network ◽  
Distorted Octahedral ◽  
Ring Motif

In the title compound, [CdL2(H2O)4]·2H2O [L= (1-ammonio-1-phosphonoethyl)phosphonate, C2H8NO6P2−], the CdIIion is situated on an inversion centre being coordinated by four aqua molecules in the equatorial plane and two phosphonate O atoms from two deprotonatedLligands in the axial positions in a distorted octahedral geometry. The asymmetric unit contains one-half of the complex molecule and one lattice water molecule. The ligandLexists in a zwitterionic form, with a positive charge on the NH3group and a negative charge on the O atom of the non-coordinating phosphonate group, and with an intramolecular O—H...O interaction forming anS(6) ring motif and two intramolecular N—H...O interactions each generating anS(5) ring motif. In the crystal, N—H...O and O—H...O hydrogen bonds link the complex molecules into a three-dimensional network in which the voids of 38 Å3are filled with ordered lattice water molecules, which are also involved in O—H...O hydrogen bonding.

scholarly journals Tetraaquabis(2,3-dihydro-1,4-benzodioxine-2-carboxylato)calcium(II)

IUCrData ◽  
2020 ◽  
Vol 5 (8) ◽  
Author(s):  
Esmit B. Camargo-Cortés ◽  
Mirna Acosta ◽  
Juan C. Martínez ◽  
Leslie W. Pineda
Keyword(s):  
Calcium Carbonate ◽  
Carboxylic Acid ◽  
Hydrogen Bonds ◽  
Title Compound ◽  
Metal Ion ◽  
Three Dimensional ◽  
Water Molecules ◽  
Acid Base ◽  
Carboxylate Ligands ◽  
Dimensional Network

The acid–base reaction of 1,4-benzodioxane 2-carboxylic acid with calcium carbonate furnished the centrosymmetric title compound, [Ca(C9H7O4)2(H2O)4], in which the metal ion is octahedrally coordinated by two monodentate 1,4-benzodioxane 2-carboxylate ligands and four water molecules. In the crystal, O—H...O and C—H...O hydrogen bonds link the molecules into a three-dimensional network.

scholarly journals Crystal structure of the tetraaquabis(thiocyanato-κN)cobalt(II)–caffeine–water (1/2/4) co-crystal

2017 ◽  
Vol 73 (7) ◽  
pp. 980-982
Author(s):  
H. El Hamdani ◽  
M. El Amane ◽  
C. Duhayon
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonds ◽  
Three Dimensional ◽  
Octahedral Geometry ◽  
Distorted Octahedral Geometry ◽  
Water Molecules ◽  
Complex Molecules ◽  
Dimensional Network ◽  
Centroid Distance ◽  
Distorted Octahedral

In the structure of the title compound [systematic name: tetraaquabis(thiocyanato-κN)cobalt(II)–1,3,7-trimethyl-1,2,3,6-tetrahydro-7H-purine-2,6-dione–water (1/2/4)], [Co(NCS)2(H2O)4]·2C8H10N4O2·4H2O, the cobalt(II) cation lies on an inversion centre and is coordinated in a slightly distorted octahedral geometry by the oxygen atoms of four water molecules and two N atoms of twotrans-arranged thiocyanate anions. In the crystal, the complex molecules interact with the caffeine molecules through O—H...N, O—H...O and C—H...S hydrogen bonds and π–π interactions [centroid-to-centroid distance = 3.4715 (5) Å], forming layers parallel to theabplane, which are further connected into a three-dimensional network by O—H...O and O—H...S hydrogen bonds involving the non-coordinating water molecules.

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