24 research outputs found

    2′,3,4,4′,5-Penta­meth­oxy­chalcone

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    In the title chalcone [systemetic name 1-(2,4-dimeth­oxy­phen­yl)-3-(3,4,5-trimeth­oxy­phen­yl)prop-2-en-1-one], C20H22O6, the dihedral angle between the plane of the two benzene rings is 7.03 (4)° with all but one of the meth­oxy groups essentially co-planar with these rings [C—C—O—C torsion angles = −76.1 (2), −0.7 (3), 1.8 (3), −6.2 (3), 2.0 (3)°]. An intra­molecular C—H⋯O inter­action occurs. The crystal packing is stabilized by weak inter­molecular C—H⋯O hydrogen bonds

    Tricarbon­yl(η6-flavone)chromium(0)

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    In the title compound, [Cr(C15H10O2)(CO)3], the Cr(CO)3 unit exhibits a three-legged piano-stool conformation. The chromium metal centre is coordinated by the phenyl ring of the flavone ligand [Cr—(phenyl centroid) distance = 1.709 (1) Å]. The ligand is approximately planar, the dihedral angles between the γ-pyrone ring and the phenyl ring and between the γ-pyrone and the phenyl­ene ring being 2.91 (5) and 3.90 (5)°, respectively. The mol­ecular packing shows π–π stacking between the flavone ligands of neighbouring mol­ecules

    Tetra­kis(μ-2-methyl­benzoato)bis­[(2-methyl­benzoic acid)copper(II)]

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    In the title centrosymmetric dinuclear compound, [Cu2(C8H7O2)4(C8H8O2)2], four o-toluate anions form a cage around two Cu atoms in a syn–syn configuration. Two more o-toluic acid mol­ecules are apically bonded to the Cu atoms, which show a square-pyramidal coordination geometry. The acid H atoms are hydrogen bonded to the cage carboxyl O atoms [O⋯O = 2.660 (2) Å]. The mol­ecular packing forms a puckered pseudo-hexa­gonal close-packed layer in the (h00) plane, with soft inter­molecular H⋯H contacts (2.46–2.58 Å)

    Racemic tricarbon­yl[7-meth­oxy-2-(η6-phen­yl)chromane]­chromium(0)

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    In the title compound, [Cr(C16H16O2)(CO)3], the Cr0 atom of the Cr(CO)3 unit is coordinated to the phenyl ring of the flavan ligand in an η6 mode, with a normal arene-to-metal distance. The Cr(CO)3 unit exhibits a three-legged piano-stool conformation, while the dihydro­pyran ring displays a distorted envelope configuration. The phenyl ring is twisted away from the fused ring system by 25.5 (2)°. The meth­oxy group is almost coplanar with the phenyl ring [CMe—O—Car—Car torsion angle = 8.46 (2)°]. The crystal packing is stabilized by inter­molecular C—H⋯O inter­actions

    5-(3,4-Dimeth­oxy­benzyl­idene)-1,3-dimethyl-1,3-diazinane-2,4,6-trione

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    In the title compound, C15H16N2O5, the dihedral angle between 1,3-diazinane and benzene rings is only 4.27 (1)°. The essentially planar mol­ecular structure is characterized by a short intra­molecular C—H⋯O separation and by an exceptionally large bond angle of 138.25 (14)° at the bridging methine C atom. The meth­oxy groups deviate somewhat from the plane of the benzene ring, with C—C—O—C torsion angles of −15.6 (1) and 9.17 (6)°. In the crystal, mol­ecules form centrosymmetric dimers via donor–acceptor π–π inter­actions, with a centroid–centroid distance of 3.401 (1) Å

    Dimethyl 2,6-dimethyl-4-phenyl­pyridine-3,5-dicarboxyl­ate

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    In the title compound, C17H17NO4, the dihedral angle between the benzene and pyridine rings is 75.51 (4)°. The benzene and pyridine rings are both approximately planar (r.m.s. deviations of 0.0040 and 0.0083 Å, respectively), indicating that the pyridine N atom is not protonated. The crystal structure is stabilized by weak inter­molecular C—H⋯O and C—H⋯N inter­actions

    Tetra­kis(μ-4-ethyl­benzoato-κ2 O:O′)­bis­[(4-ethyl­benzoic acid-κO)copper(II)]

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    The molecule of the title compound, [Cu2(C9H9O2)4(C9H10O2)2], lies on a center of inversion. It consists of four bridging ethyl­benzoate ligands, forming a cage around two Cu atoms in a syn–syn configuration, and two monodentate ethyl­benzoic acid ligands bonded apically to the square-planar Cu atoms. The Cu⋯Cu distance is 2.6047 (5) Å

    Racemic tricarbonyl[(4a,5,6,7,8,8a-η)-2-phenyl-3,4-dihydro-2H-1-benzopyran]chromium(0)

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    The title compound, [Cr(C15H14O)(CO)3], displays a distorted envelope configuration of the dihydro­pyrane ring. The dihedral angle between the phenyl and phenyl­ene rings is 50.63 (4)°. The Cr0 atom is coordinated by three CO groups and the phenyl­ene ring of the flavan ligand in an η6 mode, with a common arene-to-metal distanc

    4,5-Bis(2,4-di-tert-butyl­phen­oxy)phthalonitrile

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    In the title compound, C36H44N2O2, the dihedral angles between the phthalonitrile ring and the two di-tert-butyl­benzene rings are 68.134 (8) and 70.637 (11)°. The two nitrile groups are almost coplanar with the phthalonitrile ring except for one of the N atoms which deviates from the plane by 0.125 (4) Å. One of the tert-butyl groups is disordered over two orientations, with refined occupancies of 0.814 (6) and 0.186 (6). Intra­molecular C—H⋯O inter­actions stabilize the molecular structure. The crystal packing is stabilized by inter­molecular C—H⋯N inter­actions

    Racemic tricarbon­yl(η6-7-meth­oxy­flavan)chromium(0)

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    In the title compound [systematic name: tricarbonyl(η6-7-methoxy-2-phenyl-3,4-dihydro-2H-1-benzopyran)chromium(0)], [Cr(C16H16O2)(CO)3], the Cr(CO)3 unit is coordinated by the phenyl­ene ring of the flavan ligand, exhibiting a three-legged piano-stool conformation, with a point to plane distance of 1.750 (1) Å. The phenyl ring is twisted away from the fused ring system by 36.49 (5)° (r.m.s. deviation = 0.027 Å; fitted atoms are the C6 ring and the attached fused-ring C and O atoms). The dihydro­pyran ring displays a distorted envelope configuration by displacement of the phenyl-bearing and the adjacent ring C atoms from the fused-ring system plane by 0.356 (2) and 0.402 (2) Å, respectively
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