78 research outputs found

    Benzyl N-{2-[5-(4-chloro­phen­yl)-1,2,4-oxadiazol-3-yl]propan-2-yl}carbamate

    Get PDF
    In the title 1,2,4-oxadiazole derivative, C19H18ClN3O3, the 1,2,4-oxadiazole ring makes dihedral angles of 12.83 (8) and 4.89 (8)°, respectively, with the benzyl and 4-chloro­phenyl rings, while the dihedral angle between the benzyl and 4-chloro­phenyl rings is 11.53 (7)°. In the crystal, mol­ecules are linked by N—H⋯N hydrogen bonds into helical chains along the b axis. A weak C—H⋯π inter­action is also present

    1-{4-Chloro-2-[2-(2-fluoro­phen­yl)-1,3-dithio­lan-2-yl]phen­yl}-2-methyl-1H-imidazole-5-carbaldehyde

    Get PDF
    There are two mol­ecules in the asymmetric unit of the title imidazole derivative, C20H16ClFN2OS2. In one mol­ecule, the dithiol­ane ring is disordered over two positions in a 0.849 (9):0.151 (10) ratio. The imidazole ring makes dihedral angles of 79.56 (9) and 18.45 (9)° with the 4-chloro­phenyl and 2-fluoro­phenyl rings, respectively, in one mol­ecule; in the other mol­ecule, the corresponding angles are 82.72 (9) and 17.39 (10)°. In the crystal, mol­ecules are linked by weak C—H⋯O inter­actions and these linked mol­ecules are stacked along the b axis by π–π inter­actions with a centroid–centroid distance of 3.4922 (11) Å. In addition, π–π inter­actions between the imidazole and 2-fluoro­phenyl rings are also observed, with centroid–centroid distances of 3.4867 (11) and 3.4326 (10) Å. The crystal is further consolidated by weak C—H⋯π inter­actions. Cl⋯S [3.5185 (8) Å], C⋯O [3.192 (3) Å] and C⋯C [3.326 (2)–3.393 (3) Å] short contacts are also observed

    2-(4-Isobutyl­phen­yl)-N′-[1-(4-nitro­phen­yl)ethyl­idene]propanohydrazide

    Get PDF
    The mol­ecule of the title compound, C21H25N3O3, exists in a trans configuration with respect to the ethyl­idene unit. The dihedral angle between the two substituted benzene rings is 86.99 (7)°. The nitro group is twisted from the attached benzene ring at an angle of 17.02 (7)°. In the crystal structure, mol­ecules are linked by pairs of N—H⋯O hydrogen bonds in a face-to-face manner into centrosymmetric dimers. These dimer units are further linked into chains along the c axis by weak C—H⋯O inter­actions. These chains are stacked along the b axis. The crystal is further stabilized by weak C—H⋯π inter­actions

    N′-[(E)-1-Phenyl­ethyl­idene]benzo­hydrazide

    Get PDF
    The title compound, C15H14N2O, crystallized with two independent mol­ecules in the asymmetric unit. Both mol­ecules are non-planar and have an E configuration with respect to the C=N bond. The dihedral angles between the two benzene rings are 11.1 (2)° in one mol­ecule and 12.40 (19)° in the other. In the crystal structure, the mol­ecules are linked by N—H⋯O hydrogen bonds and weak C—H⋯O inter­actions into infinite one-dimensional chains along [1 0 0]. The crystal structure is further stabilized by N—H⋯O hydrogen bonds, weak C—H⋯O and very weak C—H⋯π inter­actions

    4-Amino-3-{1-[4-(2-methyl­prop­yl)phen­yl]eth­yl}-1H-1,2,4-triazole-5(4H)-thione

    Get PDF
    In the title triazole compound, C14H20N4S, the dihedral angle between the triazole and benzene rings is 83.29 (11)°. The methine H atom and two methyl groups of the isobutyl group are disordered over two sites with occupancies of 0.684 (9) and 0.316 (9). In the crystal structure, N—H⋯S hydrogen bonds link the mol­ecules into chains running along the b axis. These chains are cross-linked into a two-dimensional network parallel to the ab plane by C—H⋯S hydrogen bonds

    (E)-4-(Benz­yloxy)benzaldehyde thio­semicarbazone

    Get PDF
    In the title compound, C15H15N3OS, the thio­semicarbazone group adopts an E configuration with respect to the C=N bond. The benzaldehyde thio­semicarbazone fragment is almost planar [maximum deviation = 0.012 (1) Å], while the dihedral angle between the benz­yloxy and phenyl rings is 72.48 (5)°. In the crystal structure, mol­ecules are inter­connected by N—H⋯N and N—H⋯S hydrogen bonds, forming a two-dimensional network parallel to the bc plane and are further stacked along the a axis by π–π inter­actions [centroid–centroid separation 3.9043 (7) Å]. The crystal structure is also stabilized by C—H⋯π inter­actions

    Di-μ-methacrylato-κ4 O:O′-bis­[aqua­bis(1,10-phenanthroline-κ2 N,N′)copper(II)] dinitrate dihydrate

    Get PDF
    The title complex, [Cu2(C4H5O2)2(C12H8N2)2(H2O)2](NO3)2·2H2O, contains a dimeric [Cu2(C4H5O2)2(C12H8N2)2(H2O)2]2+ dication with two five-coordinated CuII ions linked by two methacrylate ions in a syn–syn bridging arrangement. The dication possesses pseudo-twofold rotational symmetry. The penta­coordination of each CuII ion has a distorted square-pyramidal geometry, with two N donors from a phenanthroline ligand and two carboxyl­ate O atoms occupying basal sites and the apical position being occupied by a water mol­ecule. In the crystal packing, mol­ecules are linked to form a three-dimensional framework by O—H⋯O and C—H⋯O hydrogen bonds and π–π inter­actions [centroid–centroid distances of 3.6039 (15), 3.5301 (15), 3.6015 (15), 3.6496 (15) and 3.6858 (15) Å]

    Benzyl 3-[(E,E)-3-phenyl­prop-2-enyl­idene]dithio­carbazate

    Get PDF
    The title compound, C17H16N2S2, a dithio­carbazate derivative, adopts an EE configuration with respect to the C=C and C=N double bonds of the propenyl­idine group. The 3-phenyl­prop-2-enyl­idene and dithio­carbazate fragments lie essentially in the same plane, with a maximum deviation from that plane of 0.074 (2) Å, while the dihedral angle between the 3-phenyl­prop-2-enyl­idene and the benzyl group is 77.78 (7)°. In the crystal structure, mol­ecules are linked by an N—H⋯S hydrogen bond and a weak C—H⋯S inter­action involving the terminal thione S atom, forming dimers that are arranged into sheets parallel to the bc plane. The crystal structure is also stabilized by C—H⋯π inter­actions

    4-[(E)-2,6-Dichloro­benzyl­ideneamino]-3-{1-[4-(2-methyl­prop­yl)phen­yl]eth­yl}-1H-1,2,4-triazole-5(4H)-thione

    Get PDF
    In the title Schiff base compound, C21H22Cl2N4S, the triazole ring makes dihedral angles of 2.15 (11) and 87.48 (11)° with the 2,6-dichloro­phenyl and methyl­propyl­phenyl rings, respectively. Weak intra­molecular C—H⋯S and C—H⋯Cl inter­actions generate S(6) and S(5) ring motifs, respectively. In the crystal structure, centrosymmetrically related mol­ecules are linked into dimers by N—H⋯S hydrogen bonds. These dimers are arranged into sheets parallel to the ab plane and are stacked along the c axis. C—H⋯π inter­actions involving the methyl­propyl­phenyl ring and π–π inter­actions involving the dichloro­phenyl ring [centroid–centroid distance = 3.5865 (3) Å] are also observed
    corecore