52 research outputs found
1-Methyl-4-[(E)-2-(2-thienyl)ethenyl]pyridinium 4-methylbenzenesulfonate1
In the title compound, C12H12NS+·C7H7O3S−, the cation exists in an E configuration with respect to the ethenyl C=C bond. The cation is essentially planar with a dihedral angle of 1.94 (10)° between the pyridinium and thiophene rings. The benzene ring of the anion makes dihedral angles of 75.23 (10) and 76.83 (10)°, respectively, with the pyridinium and thiophene rings. In the crystal structure, cations and anions form alternate layers parallel to the bc plane. Within each layer, both cations and anions are arranged into chains directed along the b axis. The cation chain and the anion chain are interconnected by weak C—H⋯O interactions into a three-dimensional network. The crystal structure is further stabilized by C—H⋯π interactions
1-Methyl-2-[(E)-2,4,5-trimethoxystyryl]pyridinium 4-methoxybenzenesulfonate monohydrate
In the title compound, C17H20NO3
+·C7H7O4S−·H2O, the cation exists in an E configuration with respect to the C=C bond and is twisted with a dihedral angle of 17.81 (8)° between the pyridinium and benzene rings. The benzene ring of the anion is almost parallel to the pyridinium ring [dihedral angle = 3.45 (9)°], whereas it is inclined to the benzene ring of the cation [dihedral angle = 17.62 (8)°]. The crystal structure is stabilized by O—H⋯O hydrogen bonds and weak C—H⋯O interactions which link the cations, anions and water molecules into chains along the a axis. π–π interactions with centroid–centroid distances of 3.7751 (9) and 3.7920 (11) Å are also observed
4-Bromo-N-(4-methoxy-2-nitrophenyl)benzamide
In the title compound, C14H11BrN2O4, the amide segment makes dihedral angles of 23.4 (2) and 20.5 (2)° with the benzene rings, while the dihedral angle between the bezene rings is 2.90 (8)°. The nitro and methoxy groups are almost coplanar with their bound benzene ring, with the r.m.s. deviation for the 11 non-H atoms being 0.0265 (1) Å. An intramolecular N—H⋯O hydrogen bond generates an S(6) ring motif. In the crystal, molecules are linked into [2-10] chains by weak C—H⋯O and C—H⋯Br interactions, which form an R
2
2(8) motif between pairs of molecules in the chain. A Br⋯O [3.2018 (12) Å] short contact also occurs
1-Methyl-2-[(E)-2-(2-thienyl)ethenyl]quinolinium 4-bromobenzenesulfonate
In the title compound, C16H14NS+·C6H4BrO3S−, the cation exists in an E configuration and is essentially planar, the dihedral angle between the quinolinium and thiophene rings being 3.45 (9)°. The anion is inclined to the cation with dihedral angles of 75.43 (8) and 72.03 (11)°, respectively between the benzene ring and the quinolinium and thiophene rings. In the crystal, the cations and anions are arranged individually into separate chains along the c axis. The cation chains are stacked in an antiparallel manner along the a axis by π⋯π interactions with centroid–centroid distances of 3.7257 (13) and 3.7262 (14) Å. Weak C—H⋯O and C—H⋯π interactions link the cations and anions into a three-dimensional network. Short Br⋯S [3.7224 (5) Å] and Br⋯O [3.4267 (16) Å] contacts are also observed
2,2′-[2,4-Bis(naphthalen-1-yl)cyclobutane-1,3-diyl]bis(1-methylpyridinium) diiodide: thermal-induced [2 + 2] cycloaddition reaction of a heterostilbene1
The asymmetric unit of the title compound, C36H32N2
2+·2I−, consists of one half-molecule of the cation and one I− anion. The cation is located on an inversion centre. The dihedral angle between the pyridinium ring and the naphthalene ring system in the asymmetric unit is 19.01 (14)°. In the crystal, the cations and the anions are linked by C—H⋯I interactions into a layer parallel to the bc plane. Intra- and intermolecular π–π interactions with centroid–centroid distances of 3.533 (2)–3.807 (2) Å are also observed
(1E,4E)-1,5-Bis(2,4,5-trimethoxyphenyl)penta-1,4-dien-3-one1
There are three molecules in the asymmetric unit of the title compound, C23H26O7, in which the dihedral angles between two benzene rings are 4.34 (9), 18.11 (8) and 8.54 (8)°. The central penta-1,4-dien-3-one fragment makes dihedral angles of 3.95 (9) and 3.32 (16)° with the two adjacent benzene rings in one molecule, whereas the corresponding pairs of angles in the other two molecules are 10.34 (9)/17.46 (8)° and 7.87 (8)/13.33 (8)°. In the crystal, molecules are linked by intermolecular C—H⋯O and C—H⋯π weak interactions into a three-dimensional network. Finally, π–π interactions [centroid⋯centroid distances = 3.5984 (10) and 3.5545 (10) Å] are observed
(E)-4-[2-(4-Ethoxyphenyl)ethenyl]-1-methylpyridinium 4-bromobenzenesulfonate methanol hemisolvate1
In the title compound, C16H18NO+·C6H4BrO3S−·0.5CH3OH, the cation exists in the E configuration and the whole molecule of the cation, except for the O atom of the ethoxy group, is disordered with a site-occupancy ratio of 0.695 (5):0.305 (5). The cation is disordered in such a way that the ethenyl units of the major and minor components are related by 180° around the long molecular axis. In the major component, the cation is almost planar, the dihedral angle between the pyridinium and benzene rings being 0.8 (3)°, whereas in the minor component, the dihedral angle between the two aromatic rings is 4.2 (6)°. In the crystal, the cations are stacked in an antiparallel manner along the a axis, while the anions and methanol molecules are linked through O—H⋯O hydrogen bonds and Br⋯O short contacts [3.0248 (13) Å] into a tape along the same direction. The three components are further linked by weak C—H⋯O, C—H⋯Br and C—H⋯π interactions
2-[(E)-2-(4-Ethoxyphenyl)ethenyl]-1-methylpyridinium iodide monohydrate
In the title compound, C16H18NO+·I−·H2O, the cation is essentially planar, with a dihedral angle of 3.13 (16)° between the pyridinium and benzene rings. The molecule adopts an E configuration with respect to the alkene double bond. In the crystal structure, the cations are packed in an anti-parallel manner through π–π interactions between adjacent pyridinium and benzene rings along the a axis, with centroid-to-centroid distances of 3.615 (2) and 3.630 (2) Å. Water molecules bind the iodide ions through O—H⋯I hydrogen bonds into layers. These layers link with the cations through weak C—H⋯O and C—H⋯I interactions
Bis[(E)-2-(3-hydroxy-4-methoxyphenyl)ethenyl]-1-methylquinolinium tetraiodidozincate(II) methanol solvate1
In the title compound, (C19H18NO2)2[ZnI4]·CH3OH, each cation is nearly planar and exists in an E configuration, the dihedral angles between the quinolinium systems and the benzene rings being 1.78 (10) and 5.44 (10)° for the two cations. The [ZnI4]2− anion displays a very slightly distorted tetrahedral geometry. There are intramolecular O—H⋯O hydrogen bonds between the hydroxy and methoxy groups in each cation which generate S(5) ring motifs. In the crystal structure, cations are linked together by O—H⋯O hydrogen bonds and weak C—H⋯O interactions, whereas the anions are linked to the cations through weak C—H⋯I interactions. The asymmetric unit also contains a methanol solvent molecule which is linked to one of the cations by an O—H⋯O hydrogen bond and the anion through an O—H⋯I hydrogen bond. The crystal is further stabilized by C—H⋯π and π–π interactions [centroid–centroid distances 3.6054 (15) and 3.6057 (15) Å]
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