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Information card for entry 4507516
Preview
Coordinates | 4507516.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C63 H39 Cl Mn2 N12 O6 |
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Calculated formula | C63 H39 Cl Mn2 N12 O6 |
Title of publication | Gas Adsorption and Magnetic Properties in Isostructural Ni(II), Mn(II), and Co(II) Coordination Polymers |
Authors of publication | Agarwal, Rashmi A.; Aijaz, Arshad; Sañudo, Carolina; Xu, Qiang; Bharadwaj, Parimal K. |
Journal of publication | Crystal Growth & Design |
Year of publication | 2013 |
Journal volume | 13 |
Journal issue | 3 |
Pages of publication | 1238 |
a | 17.275 ± 0.005 Å |
b | 17.275 ± 0.003 Å |
c | 14.107 ± 0.005 Å |
α | 90 ± 0.005° |
β | 90 ± 0.005° |
γ | 120 ± 0.005° |
Cell volume | 3645.9 ± 1.8 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 6 |
Space group number | 163 |
Hermann-Mauguin space group symbol | P -3 1 c |
Hall space group symbol | -P 3 2c |
Residual factor for all reflections | 0.0898 |
Residual factor for significantly intense reflections | 0.0535 |
Weighted residual factors for significantly intense reflections | 0.12 |
Weighted residual factors for all reflections included in the refinement | 0.1297 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.835 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4507516.html
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