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Information card for entry 4319495
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Coordinates | 4319495.cif |
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Original paper (by DOI) | HTML |
Common name | [Fe2(HPTB)(OCH3)(ONO2)2](NO3)2*4.5CH3OH |
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Chemical name | (mu-N,N,N',N'-tetrakis(2-benzimidazolylmethyl)-2-hydroxy-1,3-diaminopropane) -(mu-methoxo)-bis(nitrato-O)di-iron(iii) dinitrate penta methanol solvent |
Formula | C40.5 H54 Fe2 N14 O18.5 |
Calculated formula | C40.5 H54 Fe2 N14 O18.5 |
Title of publication | Syntheses and Structural Characterization of Dinuclear and Tetranuclear Iron(III) Complexes with Dinucleating Ligands and Their Reactions with Hydrogen Peroxide |
Authors of publication | Lars Westerheide; Felizitas K. Müller; Roberto Than; Bernt Krebs; Jens Dietrich; Siegfried Schindler |
Journal of publication | Inorganic Chemistry |
Year of publication | 2001 |
Journal volume | 40 |
Pages of publication | 1951 - 1961 |
a | 12.435 ± 0.002 Å |
b | 15.383 ± 0.003 Å |
c | 16.053 ± 0.003 Å |
α | 65.95 ± 0.03° |
β | 72.08 ± 0.03° |
γ | 74.22 ± 0.03° |
Cell volume | 2629.9 ± 1.1 Å3 |
Cell temperature | 213 ± 2 K |
Ambient diffraction temperature | 213 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1299 |
Residual factor for significantly intense reflections | 0.0725 |
Weighted residual factors for significantly intense reflections | 0.1617 |
Weighted residual factors for all reflections included in the refinement | 0.1887 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.046 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4319495.html
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