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  • Digitale Medien  (2)
  • hydrogen bonding  (2)
  • 1
    ISSN: 1572-8854
    Schlagwort(e): M(acac)3 derivatives ; isomorphous ; β-diketonate ligands ; hydrogen bonding
    Quelle: Springer Online Journal Archives 1860-2000
    Thema: Geologie und Paläontologie , Physik
    Notizen: Abstract The molecular structures of Al(tfac)3 (1), Co(tfac)3 (2) (H-tfac = 1,1,1-trifluoroacetylacetone) and Cu(H2O)(fod)2 (3) (H-fod = 1,1,1,2,2,3,3-hepta-fluoro-7,7-dimethyloctane-4,6-dione) have been determined. The metal coordination spheres in compounds 1 and 2 are essentially the same as the respective M(acac)3 derivatives. Despite the isomorphous nature of the structures of compounds 1 and 2, the identity of the nearest intermolecular van der Waals contacts are altered by minor changes in the metal coordination sphere. The geometry about copper in compound 3 is close to that of an ideal square bipyramid with the β-diketonate ligands occupying the basal plane. The water ligand in each molecule of compound 3 is hydrogen bonded to an oxygen of a β-diketonate ligand on an adjacent molecule resulting in the formation of dimers, which form rods along the y-axis due to weak C–F···Cu interactions. Crystal data: (1) orthorhombic, Pca21, a = 14.949(3), b = 19.806(4), c = 13.624(3) Å, V = 4033(1) Å3, and Z = 8, and (2) orthorhombic, Pca21, a = 14.930(3), b = 19.620(4), c = 13.540(3) Å, V = 3966(1) Å3, and Z = 8,; (3) monoclinic, P21/c, a = 12.447(3), b = 10.486(2) c = 21.980(4) Å, β = 102.65(3)°, V = 2799(1) Å3, and Z = 4.
    Materialart: Digitale Medien
    Bibliothek Standort Signatur Band/Heft/Jahr Verfügbarkeit
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  • 2
    ISSN: 1573-1111
    Schlagwort(e): Crown ether ; early transition metal ; hydrogen bonding ; crystal structure
    Quelle: Springer Online Journal Archives 1860-2000
    Thema: Chemie und Pharmazie
    Notizen: Abstract 18-crown-6 reacts with TiCl3 in CH2Cl2 to form a complex in which the crown ether functions as a tridentate ligand. Addition of moist hexane affords a molecular complex in which the crown ether functions as a bidentate ligand. A water molecule is bonded directly to the titanium atom and is further hydrogen bonded to three of the oxygen atoms of the crown. The deep blue crystals of the CH2Cl2 adduct belong to the monoclinic space groupP21/n witha=13.481(8),b=8.021(5),c=21.425(9) Å, β=97.32(5)°, andρ calc = 1.51 g cm−3 forZ=4. Refinement led to a conventionalR value of 0.040 based on 873 observed reflections. The Ti−O bond distances for the crown oxygen atoms are 2.123(8) and 2.154(9) Å, while the oxygen atom of the water molecule is bonded at 2.072(8) Å. The octahedral coordination sphere of the titanium atom is completed by the three chlorine atoms at distances of 2.340(5), 2.352(4), and 2.373(4) Å.
    Materialart: Digitale Medien
    Bibliothek Standort Signatur Band/Heft/Jahr Verfügbarkeit
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