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Information card for entry 7025900
Preview
Coordinates | 7025900.cif |
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Original paper (by DOI) | HTML |
Formula | C20 H24 B Cl2 Co N8 Rh |
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Calculated formula | C20 H24 B Cl2 Co N8 Rh |
SMILES | [Rh]1234([n]5n(ccc5)[B]5(n6[n]1ccc6)n1[n]([Co](Cl)(Cl)[n]6n5ccc6)ccc1)[CH]1=[CH]2CC[CH]4=[CH]3CC1 |
Title of publication | Homo- and heterodinuclear complexes of the tetrakis(pyrazolyl)borate ligand. |
Authors of publication | Hallett, Andrew J.; Adams, Christopher J.; Anderson, Kirsty M.; Baber, R. Angharad; Connelly, Neil G.; Prime, Christopher J. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2010 |
Journal volume | 39 |
Journal issue | 25 |
Pages of publication | 5899 - 5907 |
a | 9.7796 ± 0.0012 Å |
b | 9.8601 ± 0.0012 Å |
c | 13.4916 ± 0.0017 Å |
α | 94.068 ± 0.002° |
β | 103.562 ± 0.002° |
γ | 104.509 ± 0.002° |
Cell volume | 1212.7 ± 0.3 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 7 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0586 |
Residual factor for significantly intense reflections | 0.0353 |
Weighted residual factors for significantly intense reflections | 0.0625 |
Weighted residual factors for all reflections included in the refinement | 0.0675 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.902 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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