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Information card for entry 7021876
Preview
Coordinates | 7021876.cif |
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Original paper (by DOI) | HTML |
Formula | C114.5 H150.5 Fe6 O65 |
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Calculated formula | C114.54 H150.6 Fe6 O65 |
Title of publication | Hexanuclear and undecanuclear iron(iii) carboxylates as catalyst precursors for cyclohexane oxidation. |
Authors of publication | Milunovic, Miljan N. M.; Martins, Luísa M D R S; Alegria, Elisabete C. B. A.; Pombeiro, Armando J. L.; Krachler, Regina; Trettenhahn, Günter; Turta, Constantin; Shova, Sergiu; Arion, Vladimir B. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2013 |
Journal volume | 42 |
Journal issue | 40 |
Pages of publication | 14388 - 14401 |
a | 15.3674 ± 0.0007 Å |
b | 16.1325 ± 0.0007 Å |
c | 16.2835 ± 0.0007 Å |
α | 73.631 ± 0.002° |
β | 80.246 ± 0.003° |
γ | 65.635 ± 0.002° |
Cell volume | 3521.8 ± 0.3 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1099 |
Residual factor for significantly intense reflections | 0.0798 |
Weighted residual factors for significantly intense reflections | 0.2433 |
Weighted residual factors for all reflections included in the refinement | 0.2795 |
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 | Yes |
Has Fobs | No |
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