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August 2017 issue
metal-organic compounds
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In the title compound, the metal atom is in a pyramidal coordination geometry. Two trifluoromethanesulfonate ions are connected via hydrogen bonds to the coordinating water molecule. The crystal structure features C—H⋯N, C—H⋯O and C—H⋯F interactions.
CCDC reference: 880897
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Reaction of AgI thiocyanate with 1-(4-nitrophenyl)thiourea and triphenylphosphane leads to a mononuclear Ag(C18H15P)3(SCN) complex. In the crystal, C—H⋯N hydrogen bonds linked molecules into a two-dimensional network.
CCDC reference: 1569028
organic compounds
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The title tetracyclic steroidal compound was isolated from the Indian herb A. reticulata. It crystallizes with two independent molecules in the asymmetric unit together with a single water molecule that links the two molecules via O—H⋯O hydrogen bonds.
CCDC reference: 1564133
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The title compound crystallizes in the non-centrosymmetric space group Cc. F atoms are involved in all of the short intermolecular contacts of the crystal structure.
CCDC reference: 1565160
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The title salt crystallizes with one independent cation and anion in the asymmetric unit. In the crystal, they are linked to one another by C—H⋯O, C—H⋯N, N—H⋯N, and N—H⋯O hydrogen bonds. Two C—H⋯π interactions also occur.
CCDC reference: 1565296
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The crystal structure of the S-oxide of 2,3-dihydro-4H-pyrido[3,2-e]thiazin-4-one, reported on herein, is extremely similar to that of S-oxide of 2,3-diphenyl-2,3-dihydro-4H-1,3-benzothiazin-4-one. The thiazine rings have screw-boat conformations and the S-oxide O-atoms are pseudo-axial on the thiazine ring.
CCDC reference: 1565252
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In the title compound,the coumarin ring system is essentially planar [dihedral angle between the rings = 1.32 (16)°]. In the crystal, C—H⋯O hydrogen bonds involving the disordered phosphonate O atom as acceptor occur, which generate [100] chains.
CCDC reference: 1565652
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The title compound is almost planar (r.m.s. deviation for the non-H atoms = 0.050 Å). In the crystal, C—H⋯O and C—H⋯N hydrogen bonds link the molecules into (10-2) layers.
CCDC reference: 1565676
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The crystal structure of the title compound features C—H⋯F and C—H⋯O hydrogen bonds.
CCDC reference: 1565677
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n the title compound, a twist about the N—C single bond is observed, making the cross conjugation not as efficient as in the case of a planar structure. The borone complex displays a tetrahedral geometry. In the crystal, molecules are conected by weak C—H⋯F hydrogen bonds.
CCDC reference: 1566411
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The molecular and crystal structure of an aminoacetate derivative is reported. In the crystal, N—H⋯O hydrogen bonds link the molecules, forming chains propagating along the a-axis direction.
CCDC reference: 1566970
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The title compound crystallizes with two independent molecules (A and B) in the asymmetric unit. In the crystal, A molecules are linked by pairs of O—H⋯O hydrogen bonds, forming A–A inversion dimers. The same situation is observed for the B molecules, and both sets of inversion dimers enclose (14) ring motifs.
CCDC reference: 1530740
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The title molecule is a new polymorphic modification (β-phase). The structure features intramolecular O—H⋯N and C—H⋯O and intermolecular C—H⋯O hydrogen bonds, as well as offset π–π-stacking and C—H⋯π(ring) interactions.
CCDC reference: 1567595
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A salt of salbutamol combined with acrylic acid was investigated. In the asymmetric unit, there is a protonated salbutamol cation and an acrylate anion. The acrylate anion is linked to the salbutamol cation via and O—H⋯O and an N—H⋯O hydrogen bond. The C=C moiety of the acrylate anion is disordered over two positions. The crystal structure is stabilized by N—H⋯O and O—H⋯O hydrogen-bonding interactions.
CCDC reference: 1563663
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In the crystal, molecules are linked into a three-dimensional supramolecular network by N—H⋯N, N—H⋯O, C—H⋯O hydrogen bonds and weak C—H⋯π interactions.
CCDC reference: 1569207
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The title hydrated salt crystallized with one independent cation, an anion and half a water molecule in the asymmetric unit. In the crystal, they are linked to one another with C—H⋯Cl, O—H⋯Cl, N—H⋯O and N—H⋯Cl hydrogen bonds. Furthermore, the crystal structure is stabilized by two weak C—H⋯π interactions.
CCDC reference: 1570202
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The molecules of the title compound are arranged in layers parallel to the ab plane.
CCDC reference: 1570185
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In the title compound, the carboximidamide unit is in an anticlinal conformation with respect to the cycloheptathiophene moiety and an intramolecular N—H⋯O hydrogen bond closes an S(6) ring. In the crystal, N—H⋯O hydogen bonds link the molecules into [010] C(6) chains and a very weak C—H⋯O interaction is also observed.
CCDC reference: 1570199
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The ammonium hydrogen bis[(3-chloro-2-methylphenoxy)acetate] anion structure comprises two inversion-related components linked through a short symmetric carboxylate O⋯H⋯O hydrogen bond in which the delocalized H atom lies on an inversion centre, with the ammonium cation disordered on a second inversion centre, giving an overall two-dimensional layered supramolecular structure through N—H⋯O hydrogen bonds.
CCDC reference: 1570335
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Two hexachlorohexynediols form centrosymmetric dimers connected via hydrogen bonds. These dimers are connected by water molecules, resulting in two-dimensional layers parallel to the ab plane.
CCDC reference: 1570830
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The conformation of the title molecule is essentially planar and is stabilized by intermolecular π–π contacts.
CCDC reference: 1570310