151 research outputs found
A monoclinic polymorph of cysteamine hydrochloride
The title compound (systematic name: 2-mercaptoethanaminium chloride), C2H8NS+·Cl−, the hydrochloride salt of cysteamine, in contrast to the previously reported triclinic polymorph [Kim et al. (2002 ▶). Polyhedron, 21, 225–228], crystallized in the monoclinic crystal system. In the crystal, the cysteaminium cations are linked to the chloride anions via one S—H⋯Cl and three N—H⋯Cl hydrogen bonds. Two-dimensional slab-like networks are formed, which are stacked in [100]. This arrangement is similar to that observed in the triclinic polymorph
Dicyclohexylammonium hydrogen phenylphosphonate
In the title salt, [(C6H11)2NH2]+·[C6H5PO2(OH)]−, the anion is monodeprotonated and acts as both a hydrogen-bond donor and acceptor. The anions are linked by pairs of O—H⋯O interactions, forming inversion dimers with R
2
2(8) ring motifs. These dimers are bridged by two dicyclohexylaminium cations via pairs of N—H⋯O hydrogen bonds, giving R
4
4(12) ring motifs, forming chains propagating along [010]. The chains are bridged by C—H⋯O interactions, forming a two-dimensional network lying parallel to (101)
1,3-Benzothiazol-2-amine
In the crystal structure of the title compound, C7H6N2S, molecules related by an inversion center are linked via N—H⋯N hydrogen bonds involving the amino groups, forming dimers. In turn, these dimers are linked via a second N—H⋯N hydrogen bond, forming an infinite two-dimensional network parallel to (011)
2,2′-(Propane-2,2-diyl)bis(1H-pyrrole)
The title compound, C11H14N2, crystallized with two independent molecules (A and B) in the asymmetric unit. The two molecules differ only slightly, with the pyrrole rings being inclined to one another at a dihedral angle of 87.67 (8)° in molecule A and 88.09 (7)° in molecule B. In the crystal, there are no classical hydrogen bonds, but the two pyrrole NH groups of one molecule are involved in N—H⋯π interactions with the pyrrole rings of the other molecule. In this manner, a compact box-like arrangement of the two independent molecules is formed
4,4-Bis(1H-pyrrol-2-yl)pentanol
The title achiral compound, C13H18N2O, crystallized in the chiral monoclinic space group P21. The pyrrole rings are inclined to one another by 62.30 (11)°, and the propanol chain is in an extended conformation. In the crystal, the two pyrrole NH groups are involved in intermolecular N—H⋯O hydrogen bonds, leading to the formation of a helical arrangement propagating along the b axis. An interesting feature of the crystal structure is the absence of any conventional hydrogen bonds involving the hydroxy H atom. There is, however, a weak intermolecular O—H⋯π interaction involving one of the pyrrole rings
Bis(tetraethylammonium) bis(hydrogen l-tartrate) l-tartaric acid monohydrate
In the title compound, 2C8H20N+·2C4H5O6
−·C4H6O6·H2O, the presence of the two tetraethylammonium cations is balanced by two hydrogen l-tartrate anions. Also present in the asymmetric unit are a molecule of l-tartaric acid and a water molecule. The various components are linked by O—H⋯O hydrogen bonds. In the crystal, two-dimensional networks are formed via O—H⋯O hydrogen bonds and C—H⋯O interactions involving the water molecule, the hydrogen l-tartrate anions and the l-tartaric acid molecules. These layers, which stack along [001], are separated by tetraethylammonium cations. The latter are also involved in C—H⋯O interactions with the anions and the l-tartaric acid and water molecules participating in the two-dimensional network
Dicyclohexylammonium 3-[(hydroxymethyl)carbamoyl]propanoate
The title compound, C12H24N+·C5H8NO4
−, contains one dicyclohexylammonium cation and one 3-[(hydroxymethyl)carbamoyl]propanoate anion in the asymmetric unit. In the crystal, the ions are linked by intermolecular N—H⋯O and O—H⋯O hydrogen bonds, forming chains propagating along [100]
2,9-Dimethyl-1,10-phenanthrolin-1-ium (6-carboxy-4-hydroxypyridine-2-carboxylato-κ3 O 2,N,O 6)(4-hydroxypyridine-2,6-dicarboxylato-κ3 O 2,N,O 6)zincate(II) 2.35-hydrate: a proton-transfer compound
In the title compound, (C14H13N2)[Zn(C7H3NO5)(C7H4NO5)]·2.35H2O, the ZnII atom is coordinated by two N atoms and four O atoms from the carboxylate groups of the 4-hydroxypyridine-2,6-dicarboxylate and 6-carboxy-4-hydroxypyridine-2-carboxylate ligands, forming a distored octahedral geometry. In the anion, the two pyridine rings are inclined to one another by 87.75 (13)°. Two types of robust O—H⋯O hydrogen bond synthons, viz. R
2
2(16) and R
6
6(42), link the anions to form a two-dimensional network parallel to the bc plane. Furthermore, O—H⋯O, N—H⋯O, N—H⋯N and weak C—H⋯O hydrogen bonds connect the two dimensional networks, forming a three-dimensional structure. In the crystal, there are also C—H⋯π and π–π interactions [centroid–centroid distances of 3.5554 (18) and 3.7681 (18) Å], and C=O⋯π interactions [O⋯centroid distance = 3.117 (2) Å] present. One of the three crystal water molecules shows an occupancy of 0.35
1,4-Bis(hexyloxy)-2,5-diiodobenzene
The centrosymmetric title compound, C18H28I2O2, crystallized in the monoclinic space group P21/c with the alkyl chains having extended all-trans conformations, similar to those in the centrosymmetric bromo analogue [Li et al. (2008 ▶). Acta Cryst. E64, o1930] that crystallized in the triclinic space group P
. The difference between the two structures lies in the orientation of the two alkyl chains with respect to the C(aromatic)—O bond. In the title compound, the O—Calkyl—Calkyl—Calkyl torsion angle is 55.8 (5)°, while in the bromo analogue this angle is −179.1 (2)°. In the title compound, the C-atoms of the alkyl chain are almost coplanar [maximum deviation of 0.052 (5) Å] and this mean plane is inclined to the benzene ring by 50.3 (3)°. In the bromo-analogue, these two mean planes are almost coplanar, making a dihedral angle of 4.1 (2)°. Another difference between the crystal structures of the two compounds is that in the title compound there are no halide⋯halide interactions. Instead, symmetry-related molecules are linked via C—H⋯π contacts, forming a two-dimensional network
2,9-Dimethyl-1,10-phenanthrolin-1-ium (6-carboxy-4-hydroxypyridine-2-carboxylato-κ3 O 2,N,O 6)(4-hydroxypyridine-2,6-dicarboxylato-κ3 O 2,N,O 6)nickelate(II) 2.35-hydrate: a proton-transfer compound
The title proton-transfer compound, (C14H13N2)[Ni(C7H3NO5)(C7H4NO5)]·2.35H2O, consists of an [Ni(hypydc)(hypydcH)]− anion, a dmpH+ cation and 2.35 uncoordinated water molecules (where hypydcH2 = 4-hydroxypyridine-2,6-dicarboxylic acid and dmp = 2,9-dimethyl-1,10-phenanthroline). The NiII atom is coordinated by two N atoms and four O atoms from the carboxylate groups of the (hypydc)2− and (hypydcH)− ligands, forming a distorted octahedral environment. In the anion, the two pyridine rings are inclined to one another by 89.24 (10)°. In the crystal, cations are linked via O—H⋯O hydrogen bonds forming dimers, graph-set [R
2
2(16)], centered about inversion centers. These dimers are further linked by other cation O—H⋯O hydrogen bonds, graph-set [R
6
6(42)], forming a two-dimensional network in (011). Additional intermolecular O—H⋯O, N—H⋯O, N—H⋯N, and weak C—H⋯O hydrogen bonds, and π–π interactions [shortest centroid–centroid distance = 3.5442 (14) Å], connect the two dimensional networks, forming a three-dimensional arrangement. The H atoms of one of the methyl groups are disordered over two sites with equal occupancy
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