Synthesis, spectroscopic and crystal structure studies of N-{3-cyano-1-[2,6-di­chloro-4-(tri­fluoro­meth­yl)phen­yl]-4-(ethyl­sulfan­yl)-1H-pyrazol-5-yl}-2,2,2-tri­fluoro­acetamide

The synthesis, crystal structure, and some spectroscopic details for the phenyl­pyrazole-based insecticide N-{3-cyano-1-[2,6-di­chloro-4- (tri­fluoro­meth­yl)phen­yl]-4-(ethyl­sulfan­yl)-1H-pyrazol-5-yl}-2,2,2- tri­fluoro­acetamide (C₁₅H₈N₄Cl₂F₆OS) are presented.

Synthesis, crystal structures, and Hirshfeld analysis of three hexa­hydro­quinoline derivatives

Three hexa­hydro­quinoline derivatives were synthesized and crystallized in an effort to study the structure–activity relationships of these calcium-channel antagonists. n these hexa­hydro­quinoline derivatives, common structural features such as a flat-boat conformation of the 1,4-di­hydro­pyridine (1,4-DHP) ring, an envelope conformation of the fused cyclo­hexa­none ring, and a substituted phenyl group at the pseudo-axial position are retained. Hydrogen bonds are the main contributors to the packing of the mol­ecules in these crystals.

Synthesis, crystal structure and properties of catena-poly[[[bis­(3-methyl­pyridine-κN)nickel(II)]-di-μ-1,3-thio­cyanato] aceto­nitrile monosolvate]

In the crystal structure of the title compound, the Ni cations are octa­hedrally coordinated and linked into chains that are arranged in such a way that channels are formed in which aceto­nitrile solvate mol­ecules are embedded that can reversibly be removed.

Crystal structure of 4,5-di­methyl-1,3-dioxol-2-one

4,5-Dimethyl-1,3-dioxol-2-one crystallizes on a mirror plane in P2₁/m and forms layered sheets that comprise anti­parallel linear strands. Close O⋯H, C⋯O and C⋯C inter­molecular contacts are formed between strands and sheets.

Crystal structure of bis­{3-(3,4-di­methyl­phen­yl)-5-[6-(1H-pyrazol-1-yl)pyridin-2-yl]-4H-1,2,4-triazol-4-ido}iron(II) methanol disolvate

The title compound, a charge-neutral bis­{2-(3,4-di­methyl­phen­yl)-4H-1,2,4-triazol-3-ato)-6-(1H-πyrazol-1-yl)pyridine} iron(II) complex di­methanol solvate, is a low-spin complex with a moderately distorted pseudo­octa­hedral coordination environment of the metal ion. As a result of the cone shape, the mol­ecules are stacked in mono-periodic columns that are bound by weak hydrogen bonds into di-periodic layers, which, in turn, are arranged in a three-dimensional lattice bound by weak inter­layer inter­actions.

Synthesis, crystal structure and Hirshfeld surface analysis of aqua­(3-meth­oxy­cinnamato-κO)bis­(1,10-phenanthroline-κ²N,N′)cobalt(II) nitrate

The title compound crystallizes in the triclinic space group P with a monomeric [Co(3-meo-cin)(phen)₂(H₂O)]⁺ cation and a nitrate anion (3-meo-cin = 3-meth­oxy cinnamic acid) in the asymmetric unit. The Co^II ion is coordinated by four N atoms from two 1,10-phenanthroline ligands and two O atoms, the first from a meth­oxy cinnamate ligand and the second from a coordinated water mol­ecule, forming a distorted octa­hedral geometry.

Synthesis and crystal structure of 2-(1,3-dithietan-2-yl­idene)cyclo­hexane-1,3-dione

In the title compound, the dihedral angle between the mean planes of the cyclo­hexane and 1,3-dithietane rings is 9.1 (3)°. A short S⋯O contact is observed in the crystal.

Syntheses and structural characterizations of the first coordination polymers assembled from the Ni(cyclam)²⁺ cation and the benzene-1,3,5-tri­carboxyl­ate linker

The coordination polyhedra of the complex cations in the one-dimensional coordination polymers I and II represent tetra­gonally distorted NiN₄O₂ octa­hedra with the four N atoms of the aza­macrocyclic cyclam ligand in the equatorial planes and two O atoms of the benzene­tri­carboxyl­ate anions in the axial positions. The crystals of both compounds are composed of parallel coordination polymeric chains running along the [010] direction in I and the [110] and [10] directions in II. As a result of hydrogen-bonding inter­actions, the chains are joined together in layers oriented parallel to the (10) and (001) planes in I and II, respectively.

Synthesis and crystal structure of 2-chloro-1-(3-hy­droxy­phen­yl)ethanone

The synthesis, crystal structure, and some spectroscopic details for 2-chloro-1-(3-hy­droxy­phen­yl) ethanone, C₈H₇O₂Cl, an α-haloketone of use in organic synthesis, are described.

Synthesis, crystal structure and Hirshfeld surface analysis of catena-poly[[bis­(semicarbazide-κ²N,O)copper(II)]-μ-sulfato-κ²O:O′]

Coordination bonds of the SO₄^2– anions associate the copper(II) cations into polymeric chains running parallel to the c axis.

Crystal structure of the cubic double-perovskite Sr₂Cr_0.84Ni_0.09Os_1.07O₆

The crystal structure of the cubic double-perovskite Sr₂Cr_0.82Ni_0.11Os_1.07O₆ at 113 K is reported. The refined structure shows that this cubic form is stable at 113 K.

Crystal structure of bis­{3-(3-bromo-4-methoxyphenyl)-5-[6-(1H-pyrazol-1-yl)pyridin-2-yl]-1,2,4-triazol-3-ato}­iron(II) methanol disolvate

The title charge-neutral complex is a low-spin complex with a moderately distorted pseudo-octa­hedral coordination environment of the metal ion. As a result of their asymmetric shape, the mol­ecules stack into chains, which eventually pack into layers and, finally, into a three-dimensional network connected by weak C—H⋯N, C—H⋯C hydrogen bonds and C—H⋯π inter­actions.