Crystal structure of (-)4C7D4mer-{N-(2-aminoethyl)-1,3-propanediamine}(diethylenetriamine)cobalt(III) iodide monohydrate, (-)4C7D4mer-(Co(aepn)(dien))I3H2O.

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概要

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• The crystal structure of (−)<SUB>474</SUB><SUP>CD</SUP> <I>mer</I>-[Co{<I>N</I>-(2-aminoethyl)-1,3-propanediamine}(diethylenetriamine)]I<SUB>3</SUB>·H<SUB>2</SUB>O has been determined by means of X-ray diffraction. The crystal is monoclinic, with a space group of P2<SUB>1</SUB>, <I>a</I>=9.662(2), <I>b</I>=14.602(2), <I>c</I>=8.201(3), β=112.87(4)°, and <I>Z</I>=2. The structure was solved by the Patterson-Fourier method and refined by the full-matrix least-squares method, which yielded an <I>R</I> value of 0.060 for the 2441 observed reflections. Each ligand molecule acts as a terdentate with meridional configurations. The absolute configuration of the coordinated asymmetric nitrogen atom in <I>N</I>-(2-aminoethyl)-1,3-propanediamine was determined to be <I>R</I>. The six-membered chelate ring in <I>N</I>-(2-aminoethyl)-1,3-propanediamine adopts a chair conformation, and the conformation of the five-membered chelate ring is δ. The conformations of the two five-membered chelate rings formed by diethylenetriamine are δ and λ, and the N(secondary)-H bond is oriented toward the six-membered chelate ring formed by <I>N</I>-(2-aminoethyl)-1,3-propanediamine.

• 公益社団法人 日本化学会の論文

著者

• SATO Shoichi

  The Institure for Solid State Physics, The University of Tokyo

• Saito Yoshihiko

  Department Of Cardiology Juntendo University School Of Medicine

• Nakahara Masayoshi

  Department of Chemistry, College of Science, Rikkyo (St. Paul's) University

• Ishii Minoru

  Department of Chemistry, College of Science, Rikkyo (St. Paul's) University

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