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Information card for entry 7102689
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Coordinates | 7102689.cif |
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Original paper (by DOI) | HTML |
Common name | 2,2'-Bipyridine-bis(di(hydro)bis(1-pyrazolyl)borate iron(ii) |
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Chemical name | 2,2'-Bipyridine-bis[di(hydro)bis(1-pyrazolyl)borate iron(II) |
Formula | C22 H24 B2 Fe N10 |
Calculated formula | C22 H24 B2 Fe N10 |
SMILES | c1c2[n]([Fe]34([n]5cccn5[BH2]n5[n]3ccc5)([n]3ccccc23)[n]2cccn2[BH2]n2[n]4ccc2)ccc1 |
Title of publication | Thermal and light induced polymorphism in iron(II) spin crossover compounds. |
Authors of publication | Thompson, Amber L; Goeta, Andres E; Real, Jose A; Galet, Ana; Carmen Munoz, M |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2004 |
Journal issue | 12 |
Pages of publication | 1390 - 1391 |
a | 16.1373 ± 0.0008 Å |
b | 14.6208 ± 0.0008 Å |
c | 10.812 ± 0.0006 Å |
α | 90° |
β | 113.775 ± 0.002° |
γ | 90° |
Cell volume | 2334.5 ± 0.2 Å3 |
Cell temperature | 120 ± 2 K |
Ambient diffraction temperature | 120 ± 2 K |
Number of distinct elements | 5 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0951 |
Residual factor for significantly intense reflections | 0.0501 |
Weighted residual factors for significantly intense reflections | 0.0856 |
Weighted residual factors for all reflections included in the refinement | 0.0962 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.994 |
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/7102689.html
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