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Copper(I) coordination compounds with two bidentate chelating pyrazole ligands. X-ray crystal structures of DI-μ-chloro-bis[[N,N-bis(1- pyrazolylmethyl)aminoethane]copper(I)] and [bis(N,N-bis(1-pyrazolylmethyl)aminoethane]copper(I) triflate
Authors:Yvon C M Pennings  Willem L Driessen  Jan Reedijk
Institution:

Department of Chemistry, Gorlaeus Laboratories, Leiden University, P.O. Box 9502, 2300 RA Leiden, The Netherlands

Abstract:The pyrazole derivatives of aminoethane N,N-bis(3,5-dimethyl-1-pyrazolyl- methyl)aminoethane (aebd) and N,N-bis(1-pyrazolylmethyl)aminoethane (aebp) form co- ordination compounds with copper(I) of stoichiometry Cu(L)X], with X = Cl, Br, I and SCN, and Cu(L)2X], with X = CF3SO3 and BF4. The ligands chelate in a bidentate manner, with only the pyrazole groups coordinating. The crystal structures of two representative examples have been determined: Cu(aebp)Cl]2 is triclinic, space group PImage , with a = 8.711(2), b = 9.351(1) and c = 9.528(1) Å, greek small letter alpha = 68.57(1)°, β = 61.47(1)° and γ = 77.82(1)°, and Z = 2. Standard least-squares refinement gave R = 0.029 (Rw = 0.038) for 1804 reflections. Cu(aebp)2]CF3SO3 is monoclinic, space group P21/n, with a = 13.352(5), b = 14.663(3) and c = 15.752(4) Å, β = 117.49(3)°, and Z = 4. Standard least-squares refinement gave R = 0.029 (Rw = 0.032) for 1786 reflections. In both cases the copper environment is slightly-distorted tetrahedral. The chloride compound is dimeric with one ligand molecule (Cu---N distances of 2.011(2) and 2.047(2) Å) and two bridging chlorides per copper (Cu---Cl distances of 2.3874(8) and 2.4094(8) Å). With the non- coordinating triflate anion, a monomeric compound with two ligand molecules per copper was obtained (Cu---N distances of 2.018(4), 2.028(4), 2.049(4) and 2.050(4) Å).
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