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Information card for entry 7700583
Preview
Coordinates | 7700583.cif |
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Original paper (by DOI) | HTML |
Formula | C30 H32 Mn N5 O5 |
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Calculated formula | C30 H32 Mn N5 O5 |
Title of publication | Spin state solvomorphism in a series of rare S = 1 manganese(iii) complexes. |
Authors of publication | Barker, Andrew; Kelly, Conor T.; Kühne, Irina A; Hill, Stephen; Krzystek, J.; Wix, Paul; Esien, Kane; Felton, Solveig; Müller-Bunz, Helge; Morgan, Grace G. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2019 |
Journal volume | 48 |
Journal issue | 41 |
Pages of publication | 15560 - 15566 |
a | 7.89419 ± 0.00004 Å |
b | 24.6143 ± 0.0001 Å |
c | 14.02753 ± 0.00006 Å |
α | 90° |
β | 92.253 ± 0.0004° |
γ | 90° |
Cell volume | 2723.58 ± 0.02 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0272 |
Residual factor for significantly intense reflections | 0.0261 |
Weighted residual factors for significantly intense reflections | 0.0724 |
Weighted residual factors for all reflections included in the refinement | 0.0734 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.081 |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7700583.html
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