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Information card for entry 7101687
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Coordinates | 7101687.cif |
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Original paper (by DOI) | HTML |
Common name | Bis(2,6-di(4-chloropyrazol-1-yl)pyridine)iron(ii) ditetrafluoroborate |
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Chemical name | Bis[2,6-di(4-chloropyrazol-1-yl)pyridine]iron(II) ditetrafluoroborate |
Formula | C22 H14 B2 Cl4 F8 Fe N10 |
Calculated formula | C22 H14 B1.98 Cl4 F7.92 Fe N10 |
Title of publication | Iron(II) complexes with a terpyridine embrace packing motif show remarkably consistent cooperative spin-transitions. |
Authors of publication | Pritchard, Ruth; Kilner, Colin A; Halcrow, Malcolm A |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2007 |
Journal issue | 6 |
Pages of publication | 577 - 579 |
a | 9.6268 ± 0.0003 Å |
b | 9.6508 ± 0.0003 Å |
c | 16.5051 ± 0.0005 Å |
α | 90° |
β | 90.7285 ± 0.0012° |
γ | 90° |
Cell volume | 1533.3 ± 0.08 Å3 |
Cell temperature | 202 ± 2 K |
Ambient diffraction temperature | 202 ± 2 K |
Number of distinct elements | 7 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0791 |
Residual factor for significantly intense reflections | 0.0742 |
Weighted residual factors for significantly intense reflections | 0.2038 |
Weighted residual factors for all reflections included in the refinement | 0.2069 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.128 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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