meso-(5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradeca-1,7-diene)nickel(II) bis[dioxalato(1,10-phenanthroline)chromate(III)] octahydrate

2007 ◽  
Vol 63 (3) ◽  
pp. m815-m817
Author(s):  
Wen-Bo Wang ◽  
Li-Xin Yang ◽  
Yang Lin
Keyword(s):  
Three Dimensional ◽  
Octahedral Geometry ◽  
Title Complex ◽  
Dimensional Structure ◽  
Planar Geometry ◽  
Water Molecules ◽  
Site Symmetry ◽  
Stacking Interactions ◽  
Asymmetric Unit ◽  
Square Planar

The asymmetric unit of the title complex, [meso-Ni(1,7-CT)][Cr(C2O4)2(phen)]2·8H2O (1,7-CT is 5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradeca-1,7-diene; phen is 1,10-phenanthroline) or [Ni(C16H32N4)][Cr(C2O4)2(C12H8N2)]2·8H2O, consists of one-half of an [Ni(1,7-CT)]2+ cation, one [Cr(C2O4)2(phen)]− anion and four water molecules of crystallization. The NiII atom (site symmetry \overline{1}) is coordinated by four N atoms from the tetraazamacrocycle in a square-planar geometry, while the CrIII centre has a distorted cis-CrN2O4 octahedral geometry. A network of π–π stacking interactions and O—H...O and N—H...O hydrogen bonds helps the formation of a three-dimensional structure.

scholarly journals Poly[[tetraaquabis(μ3-5-carboxybenzene-1,2,4-tricarboxylato)tricadmium] tetrahydrate]

2012 ◽  
Vol 68 (6) ◽  
pp. m801-m802
Author(s):  
Yong-Yan Jia ◽  
Xin-Nian Xie ◽  
Huai-Xia Yang
Keyword(s):  
Water Molecule ◽  
Three Dimensional ◽  
Octahedral Geometry ◽  
Title Complex ◽  
Dimensional Structure ◽  
Distorted Octahedral Geometry ◽  
Water Molecules ◽  
Three Dimensional Structure ◽  
The Third ◽  
Distorted Octahedral

There are three independent CdII ions in the title complex, {[Cd3(C10H3O8)2(H2O)4]·4H2O} n , one of which is coordinated by four O atoms from three 5-carboxybenzene-1,2,4-tricarboxylate ligands and by two water molecules in a distorted octahedral geometry. The second CdII ion is coordinated by five O atoms from four 5-carboxybenzene-1,2,4-tricarboxylate ligands and by one water molecule also in a distorted octahedral geometry while the third CdII ion is coordinated by five O atoms from three 5-carboxybenzene-1,2,4-tricarboxylate ligands and by one water molecule in a highly distorted octahedral geometry. The 5-carboxybenzene-1,2,4-tricarboxylate ligands bridge the CdII ions, resulting in the formation of a three-dimensional structure. Intra- and intermolecular O—H...O hydrogen bonds are present throughout the three-dimensional structure.

A new polymorph of (dimethyl 5,6,7,8,15,16-hexahydro-6,7-dioxo-5,8,14,17-tetraazadibenzo[a,g]cyclotetradecine-13,18-dicarboxylato-κ4 N)nickel(II)

2006 ◽  
Vol 62 (4) ◽  
pp. m870-m872
Author(s):  
Chang-Qing Li ◽  
Li-Na Zhu ◽  
Xiao-Zeng Li ◽  
Rong Li
Keyword(s):  
Hydrogen Bonds ◽  
Macrocyclic Ligand ◽  
Three Dimensional ◽  
Title Complex ◽  
Planar Geometry ◽  
Supramolecular Network ◽  
Stacking Interactions ◽  
Complex Molecules ◽  
Π Stacking ◽  
Square Planar

A new polymorph of the title complex, [Ni(C22H18N4O6)], has been synthesized and structurally characterized. Ni(II) is coordinated by the four nitrogen donors of the macrocyclic ligand with a distorted square-planar geometry. C—H...O hydrogen bonds and π...π stacking interactions link the complex molecules, forming an infinite three-dimensional supramolecular network.

scholarly journals Dichlorido(4,4′-di-tert-butyl-2,2′-bipyridine-κ2N,N′)palladium(II) dimethyl sulfoxide monosolvate monohydrate

2014 ◽  
Vol 70 (6) ◽  
pp. m200-m201 ◽  
Author(s):  
Ricardo A. Gutiérrez-Márquez ◽  
Carmela Crisóstomo-Lucas ◽  
Reyna Reyes-Martínez ◽  
Simón Hernández-Ortega ◽  
David Morales-Morales
Keyword(s):  
Hydrogen Bonds ◽  
Dimethyl Sulfoxide ◽  
Title Compound ◽  
Three Dimensional ◽  
Planar Geometry ◽  
Water Molecules ◽  
Stacking Interactions ◽  
Bite Angle ◽  
Linear Chains ◽  
Square Planar

The title compound, [PdCl2(C18H24N2)]·(CH3)2SO·H2O, the PdIIion is in a distorted square-planar geometry. The Pd—N bond distances are 2.022 (2) and 2.027 (2) Å, the Pd—Cl bond distances are 2.2880 (7) and 2.2833 (7) Å, and the ligand bite angle is 80.07 (9)°. The dimethyl sulfoxide and water molecules form linear chains along [100] by O—H...O and O—H...S hydrogen bonds, generating eight- and 12-membered rings. C—H...Cl interactions link the chains, forming a three-dimensional arrangement. In addition, the 4,4-di-tert-butyl-2,2′-bipyridine ligand exhibits π–π stacking interactions [centroid–centroid distances = 3.8741 (15) and 3.8353 (15) Å]. The DMSO solvent is disordered and was refined with an occupancy ratio of 0.866 (3):0.134 (3).

scholarly journals Crystal structure of a heterometallic coordination polymer: poly[diaquabis(μ7-benzene-1,3,5-tricarboxylato)dicalcium(II)copper(II)]

2017 ◽  
Vol 73 (6) ◽  
pp. 835-837
Author(s):  
Feng Zhang ◽  
Bing-Guang Zhang
Keyword(s):  
Coordination Polymer ◽  
Octahedral Geometry ◽  
Title Complex ◽  
Distorted Octahedral Geometry ◽  
Planar Geometry ◽  
Water Molecules ◽  
Centroid Distance ◽  
Square Planar ◽  
Distorted Octahedral ◽  
Benzene Rings

In the title complex, [Ca2Cu(C9H3O6)2(H2O)2]n, the CaIIand CuIIcations are bridged by the benzene-1,3,5-tricarboxylate anions (BTC3−) to form the coordination polymer, in which each BTC3−anion bridges two CuIIand five CaIIcations with a μ7coordination mode. The CuIIcation, located at an inversion centre, is in a nearly square-planar geometry defined by four O atoms from four bridging BTC3−anions, while the CaIIcation is in a distorted octahedral geometry defined by five O atoms from bridging BTC3−anions and one water molecule. O—H...O hydrogen bonds between coordinating water molecules and carboxyl groups further stabilize the structure; π–π stacking is also observed between parallel benzene rings, the centroid-to-centroid distance being 3.357 (2) Å.

scholarly journals Aqua(4-bromobenzoato-κO)bis(1,10-phenanthroline-κ2N,N′)manganese(II) 4-bromobenzoate dihydrate

IUCrData ◽  
2016 ◽  
Vol 1 (5) ◽  
Author(s):  
Ling-Xia Hu ◽  
Bi-Song Zhang
Keyword(s):  
Complex Cation ◽  
Three Dimensional ◽  
Octahedral Geometry ◽  
Distorted Octahedral Geometry ◽  
Water Molecules ◽  
Stacking Interactions ◽  
Asymmetric Unit ◽  
Lattice Water ◽  
Dimensional Network ◽  
Distorted Octahedral

The asymmetric unit of the title compound, [Mn(C7H4BrO2)(C12H8N2)2(H2O)](C7H4BrO2)·2H2O, consists of a monovalent [Mn(C7H4BrO2)(C12H8N2)2(H2O)]+complex cation, a 4-bromobenzoate anion and two lattice water molecules. In the complex cation, the MnIIatom is coordinated by four N atoms from two bidentate chelating 1,10-phenanthroline (phen) ligands and two O atoms, one from a 4-bromobenzoate anion and the other from a coordinating water molecule. This completes an MnN4O2coordination sphere with a distorted octahedral geometry. The Br atom of the bromobenzoato ligand is equally disordered over two sites. In the crystal, the complex cations are connected to each otherviaO—H...O, O—H...Br and C—H...O hydrogen bonds and π–π stacking interactions [closest separation = 3.492 (4) Å]. π–π contacts [closest separation = 3.771 (4) Å] also link the complex cations to both the coordinated and non-coordinating 4-bromobenzoate anions. Overall, these contacts generate a three-dimensional network structure.

scholarly journals trans-Bis(5-amino-1,3,4-thiadiazol-2-thiolato-κS2)bis(triphenylphosphane-κP)palladium(II) dimethyl sulfoxide disolvate hemihydrate

2012 ◽  
Vol 68 (4) ◽  
pp. m483-m484
Author(s):  
Felipe Chontal-Vidal ◽  
Maricela Arroyo-Gómez ◽  
Simón Hernández-Ortega ◽  
Reyna Reyes-Martínez ◽  
David Morales-Morales
Keyword(s):  
Dimethyl Sulfoxide ◽  
Complex Molecule ◽  
Title Complex ◽  
Molar Ratio ◽  
Planar Geometry ◽  
Water Molecules ◽  
Asymmetric Unit ◽  
Square Planar ◽  
Thiadiazole Ring ◽  
A Chain

The title complex, [Pd(C2H2N3S2)2(C18H15P)2]·2C2H6OS·0.5H2O, was obtained from the reaction oftrans-[(Ph3P)2PdCl2] with 5-amino-1,3,4-thiadiazole-2-thione (SSNH2) in a 2:1 molar ratio. The PdIIatom, located in a crystallographic center of symmetry, has a square-planar geometry with two triphenylphosphineP-coordinated molecules and two SSNH2ligands with the S atoms in atransconformation. The latter ligand exhibits N—H...N hydrogen-bonding contacts formed by the amino group with the thiadiazole ring, generating a chain along thecaxis. The asymmetric unit contains one half of the complex molecule along with disordered dimethyl sulfoxide and water molecules.

scholarly journals Crystal structure of aqua{μ-N-[3-(dimethylamino)propyl]-N′-2-(oxidophenyl)oxamidato}(1,10-phenanthroline-5,6-dione)dicopper(II) perchlorate hemihydrate

2015 ◽  
Vol 71 (6) ◽  
pp. 667-670
Author(s):  
Xin Zhang ◽  
Yan-Tuan Li ◽  
Zhi-Yong Wu
Keyword(s):  
Water Molecule ◽  
Complex Cation ◽  
Three Dimensional ◽  
Planar Geometry ◽  
Water Molecules ◽  
Stacking Interactions ◽  
Solvent Water Molecule ◽  
Solvent Water ◽  
Hydrogen Bonding Interactions ◽  
Square Planar

The title compound, [Cu2(C13H16N3O3)(C12H6N2O2)(H2O)]ClO4·0.5H2O, consists of acis-oxamide-bridged binuclear CuIIcomplex cation, a perchlorate anion and half a solvent water molecule. One CuIIcation isN,N′,N",O-chelated by anN-[3-(dimethylamino)propyl]-N′-(2-hydroxyphenyl)oxamide trianion in a distorted square-planar geometry, whereas the other CuIIcation isO,O′-chelated by the oxamide moiety of the anion andN,N′-chelated by a 1,10-phenanthroline-5,6-dione molecule, and a water molecule further coordinates the second CuIIcation, completing a distorted square-pyramidal coordination geometry. In the crystal, classical O—H...O hydrogen bonds, weak C—H...O hydrogen-bonding interactions and π–π stacking interactions link the complex cations, anions and solvent water molecules into a three-dimensional supramolecular architecture. In the crystal, the dimethylaminopropyl unit of the oxamide anion is disordered over two positions with an occupancy ratio of 0.561 (11):0.439 (11); the solvent water molecule is also disordered over two positions, the occupancy ratio being 0.207 (10):0.293 (10).

Bis[1,3-bis(1H-benzimidazol-2-yl)benzene-κN 3]bis(nitrato-κ2 O,O′)cadmium(II) dihydrate

2007 ◽  
Vol 63 (11) ◽  
pp. m2752-m2752 ◽  
Author(s):  
Fa-Yan Meng ◽  
Yi-Ming Zhang ◽  
Seik Weng Ng
Keyword(s):  
Crystal Structure ◽  
Three Dimensional ◽  
Octahedral Geometry ◽  
Title Complex ◽  
Distorted Octahedral Geometry ◽  
Water Molecules ◽  
Complex Molecules ◽  
Solvent Water ◽  
Dimensional Network ◽  
Distorted Octahedral

In the title complex, [Cd(NO3)2(C20H14N4)2]·2H2O, the CdII ion, which lies on a crystallographic twofold axis, is bis-chelated by two nitrate ligands and is coordinated by one tertiary N atom from each of two 1,3-bis(1H-benzimidazol-2-ylmethyl)benzene ligands in a distorted octahedral geometry. In the crystal structure, complex molecules and solvent water molecules are connected via hydrogen bonds to form a three-dimensional network.

scholarly journals cis-Tetraaquabis{5-[4-(1H-imidazol-1-yl-κN3)phenyl]tetrazolido}manganese(II) dihydrate

2012 ◽  
Vol 68 (4) ◽  
pp. m413-m414 ◽  
Author(s):  
Xin Wang ◽  
Shi-Wei Yan ◽  
Suo-Cheng Chang ◽  
Yan-Chen Liang ◽  
Fu-Tian Zhang
Keyword(s):  
Hydrogen Bonds ◽  
Rotation Axis ◽  
Three Dimensional ◽  
Imidazole Ring ◽  
Octahedral Geometry ◽  
Dimensional Structure ◽  
Distorted Octahedral Geometry ◽  
Water Molecules ◽  
Solvent Water ◽  
Distorted Octahedral

In the title compound, [Mn(C10H7N6)2(H2O)4]·2H2O, the complex unit comprises an Mn2+ion, coordinated by two imidazole N atoms fromcis-related monodentate 5-[4-(imidazol-1-yl)phenyl]tetrazolide ligands and four water molecules, together with two water molecules of solvation. The Mn2+ion lies on a twofold rotation axis and has a slightly distorted octahedral geometry. The molecules are connected by O—H...N and O—H...O hydrogen bonds involving both coordinated and solvent water molecules, generating a three-dimensional structure. Two C atoms of the imidazole ring of the ligand are each disordered over two sites with occupancy factors of 0.75 and 0.25.

scholarly journals Diaquabis[5-(pyrazin-2-yl-κN1)-3-(pyridin-3-yl)-1,2,4-triazolido-κN1]zinc

2014 ◽  
Vol 70 (4) ◽  
pp. m116-m116
Author(s):  
Ye-Nan Wang ◽  
Wen-Wen Dong
Keyword(s):  
Hydrogen Bonds ◽  
Three Dimensional ◽  
Triazole Ring ◽  
Octahedral Geometry ◽  
Water Molecules ◽  
Stacking Interactions ◽  
Supramolecular Architecture ◽  
Inversion Center ◽  
Aromatic Rings ◽  
Anionic Ligand

In the title compound, [Zn(C11H7N6)2(H2O)2], the ZnIIcation, located on an inversion center, isN,N′-chelated by two 5-(pyrazin-2-yl)-3-(pyridin-3-yl)-1,2,4-triazolide anions and is further coordinated by two water molecules in a distorted N4O2octahedral geometry. In the anionic ligand, the pyrazine and pyridine rings are twisted with respect to the central triazole ring by 5.77 (10) and 11.54 (10)°, respectively. In the crystal, classical O—H...N and weak C—H...O hydrogen bonds and π–π stacking interactions between aromatic rings [the centroid–centroid distances between triazole and pyrazine rings, and between triazole and pyridine rings are 3.623 (2) and 3.852 (2) Å, respectively] connect the molecules into a three-dimensional supramolecular architecture.

Sign in / Sign up

Export Citation Format

Share Document