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Information card for entry 4066406
Preview
Coordinates | 4066406.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C15 H19 B Br2 Fe |
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Calculated formula | C15 H19 B Br2 Fe |
SMILES | B([c]12[Fe]3456789([cH]1[cH]3[cH]4[cH]25)[c]1([c]9([c]8([c]7([c]61C)C)C)C)C)(Br)Br |
Title of publication | Reactivity of [(C5Me5)Fe(C5H4BBr2)] and [(OC)3Mn(C5H4BBr2)] toward Et3SiH: Facile Access to [(OC)3Mn(C5H4BH2)]2and to Boron-Bridged Dinuclear Organometallics† |
Authors of publication | Eckensberger, U. David; Weber, Mitra; Wildt, Julia; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias |
Journal of publication | Organometallics |
Year of publication | 2010 |
Journal volume | 29 |
Journal issue | 21 |
Pages of publication | 5301 |
a | 7.2326 ± 0.0009 Å |
b | 8.662 ± 0.0011 Å |
c | 13.1522 ± 0.0017 Å |
α | 92.874 ± 0.011° |
β | 91.017 ± 0.011° |
γ | 106.655 ± 0.01° |
Cell volume | 787.96 ± 0.18 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 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 | 0.0717 |
Residual factor for significantly intense reflections | 0.0479 |
Weighted residual factors for significantly intense reflections | 0.1114 |
Weighted residual factors for all reflections included in the refinement | 0.1206 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.928 |
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/4066406.html
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