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Data for the X-ray structure analyses: 2 x 2 H2O: C16H18Cl2N4O2, Mr, 369.24, triclinic, space group P1, a, 6.799(1, b, 10.256(2, c, 12.993(2) Å, α, 111.463(8, β, 93.785(9, γ, 103.935(9)°, V, 806.4(2) Å3, Z, 2, T, 100(2) K, F000, 384, μ, 0.420 mm-1, Θ, 3.54-30.51°, 13436 reflections collected, 4865 independent reflections [Rint, 0.0728, GoF, 1.063, R, 0.0487, wR2, 0.1043, largest diffraction peak and hole 0.574/-0.380 e Å-3. 3 x 2 H2O: C16H20Cl2N4O2, Mr, 371.26, triclinic, space group P1, a, 6.886(1, b, 8.008(1, c, 9.206(1) Å, α, 65.641, β
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[10] All hydrogen atoms were added geometrically and refined using a riding model. CCDC-600366 (2) and CCDC-600367 (3) contain the supplementary crystallographic data for this paper. These data can be obtained free of charge from The Cambridge Crystallographic Data Centre via www.ccdc.cam.ac.uk/data_request/cif.
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Of course the effect of Fe binding is not considered here, but the measurements with the uncomplexed bpmp show a significant effect of the solvent that fits the experimental observations very well, so that we conclude that the trend is the same for the iron-bound ligand
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Of course the effect of Fe binding is not considered here, but the measurements with the uncomplexed bpmp show a significant effect of the solvent that fits the experimental observations very well, so that we conclude that the trend is the same for the iron-bound ligand.
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