scholarly journals Chlorido(2,2′-{[2-(1-methyl-1H-imidazol-2-yl-κN 3)imidazolidine-1,3-diyl-κN]bis(methylene)}bis(1-methyl-1H-imidazole-κN 3))copper(II) perchlorate

2019 ◽  
Vol 75 (5) ◽  
pp. 547-551
Author(s):  
Diego da Silva Padilha ◽  
Marciela Scarpellini
Keyword(s):  
Crystal Structure ◽  
Intermolecular Interactions ◽  
Title Complex ◽  
Stacking Interactions ◽  
Metal Centre ◽  
Pyramidal Geometry ◽  
Π Stacking ◽  
Methyl Imidazole ◽  
Square Pyramidal Geometry

In the crystal structure of the title complex, [CuCl(C17H24N8)]ClO4, the copper(II) metal exhibits an N4Cl pentacoordinate environment in a distorted square-pyramidal geometry. Coordination to the metal centre occurs through the three 1-methylimidazole N atoms from the pendant groups, one amine N atom from the imidazolidine moiety and one chlorido anion. Intermolecular interactions take place at two of the 1-methyl-imidazole rings in the form of parallel-displaced π–π stacking interactions forming chains parallel to the a axis. Three O atoms of the perchlorate anion are rotationally disordered between two orientations with occupancies of 0.5.

scholarly journals catena-Poly[[[4-amino-3,5-bis(pyridin-2-yl)-4H-1,2,4-triazole-κ2N1,N5](dicyanamido-κN)copper(II)]-μ2-dicyanamido-κ2N:N′]: coordination polymer chains linked into a bilayer by hydrogen bonds and π–π stacking interactions

2014 ◽  
Vol 70 (4) ◽  
pp. 359-363 ◽  
Author(s):  
Zouaoui Setifi ◽  
Fatima Setifi ◽  
Mohamed Saadi ◽  
Djamil-Azzeddine Rouag ◽  
Christopher Glidewell
Keyword(s):  
Coordination Polymer ◽  
Hydrogen Bonds ◽  
Polymer Chains ◽  
Stacking Interactions ◽  
Terminal Ligand ◽  
One Dimensional ◽  
Bridging Ligand ◽  
Pyramidal Geometry ◽  
Π Stacking ◽  
Square Pyramidal Geometry

In the title compound, [Cu(C2N3)2(C12H10N6)]nor [Cu(dca)2(abpt)]n, where abpt is 4-amino-3,5-bis(pyridin-2-yl)-4H-1,2,4-triazole and dca is the dicyanamide anion, the CuIIcentre is five-coordinate with an approximately square-pyramidal geometry. One of the two dicyanamide ligands is a terminal ligand, but the other one acts as a μ1,5-bridging ligand between pairs of CuIIcentres, so generating a one-dimensional coordination polymer. A combination of N—H...N and C—H...N hydrogen bonds, augmented by π–π stacking interactions, links the coordination polymer chains into a bilayer structure. Comparisons are made with some related CuIIcomplexes containing dca ligands and heteroaromatic co-ligands.

[2,5-Bis(2,2′-bipyridyl-6-yl)-3,4-diazahexa-2,4-diene]dichloridomanganese(II): from a mononuclear compound to a three-dimensional supramolecular framework through C—H...Cl hydrogen bonds and π–π stacking interactions

2014 ◽  
Vol 70 (7) ◽  
pp. 718-721
Author(s):  
Zhengliang Lu ◽  
Yuanchao Zhao ◽  
Baolian Chen ◽  
Ximing Huang ◽  
Chunhua Fan
Keyword(s):  
Hydrogen Bonds ◽  
Three Dimensional ◽  
Stacking Interactions ◽  
Dimensional Chain ◽  
Supramolecular Framework ◽  
One Dimensional ◽  
Pyramidal Geometry ◽  
Π Stacking ◽  
Square Pyramidal Geometry ◽  
Multifunctional Ligand

The title compound, [MnCl2(C24H20N6)], has been synthesized and characterized based on the multifunctional ligand 2,5-bis(2,2′-bipyridyl-6-yl)-3,4-diazahexa-2,4-diene (L). The MnIIcentre is five-coordinate with an approximately square-pyramidal geometry. TheLligand acts as a tridendate chelating ligand. The mononuclear molecules are bridged into a one-dimensional chain by two C—H...Cl hydrogen bonds. These chains are assembled into a two-dimensional layer through π–π stacking interactions between adjacent uncoordinated bipyridyl groups. Furthermore, a three-dimensional supramolecular framework is attained through π–π stacking interactions between adjacent coordinated bipyridyl groups.

Dependence of the Distortion of the Square Pyramids in N, N-Dimethylethylenediammonium Pentachloroantimonate(III) on the Geometry of Hydrogen Bonds

2001 ◽  
Vol 56 (6) ◽  
pp. 521-525 ◽  
Author(s):  
Maciej Bujak ◽  
Jacek Zaleski
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonds ◽  
Intermolecular Interactions ◽  
Mean Value ◽  
The Other ◽  
Monoclinic System ◽  
Bond Lengths ◽  
Pyramidal Geometry ◽  
The Mean ◽  
Square Pyramidal Geometry

AbstractN ,N-Dimethylethylenediammonium pentachloroantimonate(III) crystallizes in the monoclinic system, in space group P21/c (a = 12.460(2), b = 10.252(2), c = 10.330(2) Å, β = 97.75(3)°, V = 1307.5(4) Å3, Z = 4, dc = 1.997, dm = 1.99(2) g/cm3). The crystal structure of [(CH3)2NH(CH2)2NH3][SbCl5] consists of isolated [SbCl5]2- anions and [(CH3)2NH(CH2)2NH3]2+ cations. The [SbCl5]2- anion has a distorted square pyramidal geometry, presenting one short axial and four long equatorial Sb-Cl bonds. The square pyramids are characteristically stacked one close to the other, parallel to the c axis. The voids between the anionic sublattice are filled by [(CH3)2NH(CH2)2NH3]2+ cations. The five non-equivalent Sb-Cl bond distances within the [SbCl5]2- square pyramid are significantly different. The equatorial Sb-Cl bonds are in the range 2.427(2)-2.968(2) Å, whereas the axial one is 2.384(1) Å long. The study reveals that N-H...C1 hydrogen bonds are responsible for the deformation of equatorial Sb-Cl bonds from the mean value of 2.654(7) Å. Analysis of intermolecular interactions between the [SbCl5]2- pyramids in the structure, reflected in changes of Sb-Cl bond lengths from the values characteristic of non-interacting pyramids, leads to the conclusion that the van der Waals radius of Sb is significantly smaller than that estimated by Pauling.

(2,2′-Bipyridyl-κ2 N,N′)(succinamidato-κN)silver(I)

2007 ◽  
Vol 63 (11) ◽  
pp. m2753-m2753 ◽  
Author(s):  
David R. Whitcomb ◽  
Manju Rajeswaran
Keyword(s):  
Crystal Structure ◽  
Title Complex ◽  
Stacking Interactions ◽  
Π Stacking ◽  
Centrosymmetric Dimers

In the molecular title complex, [Ag(C4H4NO2)(C10H8N2)], the Ag atom adopts a distorted T-shaped AgN3 coordination. Aromatic π–π stacking interactions [centroid–centroid separation = 3.8393 (17) Å] lead to centrosymmetric dimers of molecules in the crystal structure.

scholarly journals Crystal structure of (4-cyanopyridine-κN){5,10,15,20-tetrakis[4-(benzoyloxy)phenyl]porphyrinato-κ4N}zinc–4-cyanopyridine (1/1)

2016 ◽  
Vol 72 (2) ◽  
pp. 164-169 ◽  
Author(s):  
Soumaya Nasri ◽  
Nesrine Amiri ◽  
Ilona Turowska-Tyrk ◽  
Jean-Claude Daran ◽  
Habib Nasri
Keyword(s):  
Crystal Structure ◽  
Bond Length ◽  
Title Compound ◽  
Axial Ligand ◽  
Complex Molecules ◽  
Zinc Cation ◽  
Π Interactions ◽  
Pyramidal Geometry ◽  
Π Stacking ◽  
Square Pyramidal Geometry

In the title compound, [Zn(C72H44N4O8)(C6H4N2)]·C6H4N2or [Zn(TPBP)(4-CNpy]·(4-CNpy) [where TPBP and 4-CNpy are 5,10,15,20-(tetraphenylbenzoate)porphyrinate and 4-cyanopyridine, respectively], the ZnIIcation is chelated by four pyrrole-N atoms of the porphyrinate anion and coordinated by a pyridyl-N atom of the 4-CNpy axial ligand in a distorted square-pyramidal geometry. The average Zn—N(pyrrole) bond length is 2.060 (6) Å and the Zn—N(4-CNpy) bond length is 2.159 (2) Å. The zinc cation is displaced by 0.319 (1) Å from the N4C20mean plane of the porphyrinate anion toward the 4-cyanopyridine axial ligand. This porphyrinate macrocycle exhibits major saddle and moderate ruffling and doming deformations. In the crystal, the [Zn(TPBP)(4-CNpy)] complex molecules are linked togetherviaweak C—H...N, C—H...O and C—H...π interactions, forming supramolecular channels parallel to thecaxis. The non-coordinating 4-cyanopyridine molecules are located in the channels and linked with the complex molecules,viaweak C—H...N interactions and π-π stacking orviaweak C—H...O and C—H...π interactions. The non-coordinating 4-cyanopyridine molecule is disordered over two positions with an occupancy ratio of 0.666 (4):0.334 (4).

scholarly journals Crystal structure of (pyridine-κN)bis(quinolin-2-olato-κ2N,O)copper(II) monohydrate

2015 ◽  
Vol 71 (2) ◽  
pp. m38-m39
Author(s):  
Benjamin Hawks ◽  
Jingjing Yan ◽  
Prem Basa ◽  
Shawn Burdette
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonds ◽  
Water Molecule ◽  
Crystal Lattice ◽  
Copper Complexes ◽  
Title Complex ◽  
Dihedral Angles ◽  
Pyridine Ligand ◽  
Pyramidal Geometry ◽  
Square Pyramidal Geometry

The title complex, [Cu(C9H6NO)2(C5H4N)]·H2O, adopts a slightly distorted square-pyramidal geometry in which the axial pyridine ligand exhibits a long Cu—N bond of 2.305 (3) Å. The pyridine ligand forms dihedral angles of 79.5 (5) and 88.0 (1)° with the planes of the two quinolin-2-olate ligands, while the dihedral angle between the quinoline groups of 9.0 (3)° indicates near planarity. The water molecule connects adjacent copper complexes through O—H...O hydrogen bonds to phenolate O atoms, forming a network interconnecting all the complexes in the crystal lattice.

(Malonato-κ2 O,O′)(1,10-phenanthroline-κ2 N,N′)palladium(II)

2006 ◽  
Vol 62 (7) ◽  
pp. m1471-m1473
Author(s):  
Nobuo Okabe ◽  
Yasunori Muranishi ◽  
Mamiko Odoko
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bonding ◽  
Title Complex ◽  
Planar Geometry ◽  
Stacking Interactions ◽  
Π Stacking ◽  
Square Planar ◽  
Phenanthroline Ligand

In the title complex, [Pd(C3H2O4)(C12H8N2)], the PdII center has a distorted cis-square-planar geometry defined by an O,O′-bidentate malonate ligand and a chelating 1,10-phenanthroline ligand. The crystal structure is stabilized by intermolecular π–π stacking interactions between pairs of 1,10-phenanthroline rings, as well as C—H...O hydrogen bonding.

scholarly journals Crystal structure and Hirshfeld surface analysis of (aqua-κO)(methanol-κO)[N-(2-oxidobenzylidene)threoninato-κ3 O,N,O′]copper(II)

2020 ◽  
Vol 76 (9) ◽  
pp. 1539-1542
Author(s):  
Natsuki Katsuumi ◽  
Yuika Onami ◽  
Sayantan Pradhan ◽  
Tomoyuki Haraguchi ◽  
Takashiro Akitsu
Keyword(s):  
Crystal Structure ◽  
Water Molecule ◽  
Surface Analysis ◽  
Complex Molecule ◽  
Hirshfeld Surface ◽  
Title Complex ◽  
Hirshfeld Surface Analysis ◽  
Tridentate Ligand ◽  
Pyramidal Geometry ◽  
Square Pyramidal Geometry

In the title complex molecule, [Cu(C11H11NO4)(CH4O)(H2O)], the Cu atom is coordinated in a distorted square-pyramidal geometry by a tridentate ligand synthesized from L-threonine and salicylaldehyde, one methanol molecule and one water molecule. In the crystal, the molecules show intra- and intermolecular O—H...O hydrogen bonds. The Hirshfeld surface analysis indicates that the most important contributions to the packing are H...H (49.4%) and H...O/O...H (31.3%) contacts.

An Asymmetric Salen-type Bisoxime Ligand and Its Supramolecular Copper(II) Complex: Synthesis, Crystal Structure and Spectral Properties

2012 ◽  
Vol 67 (3) ◽  
pp. 197-203 ◽  
Author(s):  
Wen-Kui Dong ◽  
Yin-Xia Sun ◽  
Si-Jia Xing ◽  
Yuan Wang ◽  
Xiong-Hou Gao
Keyword(s):  
Crystal Structure ◽  
Molar Conductance ◽  
Stacking Interactions ◽  
X Ray Diffraction ◽  
X Ray ◽  
Pyramidal Geometry ◽  
Vis Spectroscopy ◽  
Dta Analysis ◽  
Coordinated Water ◽  
Square Pyramidal Geometry

A supramolecular Cu(II) complex [CuL(H2O)] with an asymmetric salen-type bisoxime ligand (H2L = 4-nitro-6ʹ-methoxy-2,2ʹ-[ethylenediyldioxybis(nitrilomethylidyne)]diphenol) has been synthesized and characterized by elemental analysis, IR and UV/Vis spectroscopy, TG-DTA analysis, and molar conductance measurements. The crystal structure of the Cu(II) complex has been determined by single-crystal X-ray diffraction. The Cu(II) atom is penta-coodinated by N2O2 donor atoms from the asymmetic salen-type bisoxime L2− unit and one oxygen atom from the coordinated water molecule, resulting in an almost regular square-pyramidal geometry. With the help of intermolecular O-H· · ·O, C-H· · ·O hydrogen bonding and π · · ·π stacking interactions, a self-assembled 3D supramolecular structure is formed.

scholarly journals Crystal structure and Hirshfeld surface analysis of diiodido{N′-[(E)-(phenyl)(pyridin-2-yl-κN)methylidene]pyridine-2-carbohydrazide-κ2 N′,O}cadmium(II)

2019 ◽  
Vol 75 (7) ◽  
pp. 1061-1064
Author(s):  
Zeliha Atioğlu ◽  
Farhad Akbari Afkhami ◽  
Mehmet Akkurt ◽  
Ali Akbar Khandar ◽  
Duane Choquesillo-Lazarte
Keyword(s):  
Crystal Structure ◽  
Hydrogen Bond ◽  
Title Compound ◽  
Hirshfeld Surface ◽  
Stacking Interactions ◽  
Asymmetric Unit ◽  
Apical Position ◽  
Pyramidal Geometry ◽  
Independent Molecules ◽  
Square Pyramidal Geometry

In each of the two independent molecules in the asymmetric unit of the title compound, [CdI2(C18H14N4O)], the N,O,N′-tridentate N′-[(E)-(phenyl)(pyridin-2-yl-κN)methylidene]pyridine-2-carbohydrazide ligand and two iodide anions form an I2N2O pentacoordination sphere, with a distorted square-pyramidal geometry, with an I atom in the apical position. Both molecules feature an intramolecular N—H...N hydrogen bond. In the crystal, weak aromatic π–π stacking interactions [centroid–centroid separation = 3.830 (2) Å] link the molecules into dimers.

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