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Information card for entry 2243406
Preview
Coordinates | 2243406.cif |
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Structure factors | 2243406.hkl |
Original IUCr paper | HTML |
Chemical name | Poly[bis(μ~3~-3,4-diaminobenzoato-κ^3^<i>N</i>^3^,<i>O</i>,<i>O</i>')manganese(II)] |
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Formula | C14 H14 Mn N4 O4 |
Calculated formula | C14 H14 Mn N4 O4 |
Title of publication | Hydrothermal synthesis and crystal structure of poly[bis(μ~3~-3,4-diaminobenzoato)manganese], a layered coordination polymer |
Authors of publication | Khosa, Muhammad Kaleem; Wood, Paul T.; Humphrey, Simon M.; Harrison, William T. A. |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2020 |
Journal volume | 76 |
Journal issue | 6 |
Pages of publication | 909 - 913 |
a | 11.5171 ± 0.0005 Å |
b | 4.4212 ± 0.0002 Å |
c | 13.9752 ± 0.0007 Å |
α | 90° |
β | 104.698 ± 0.003° |
γ | 90° |
Cell volume | 688.32 ± 0.06 Å3 |
Cell temperature | 180 ± 2 K |
Ambient diffraction temperature | 180 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0423 |
Residual factor for significantly intense reflections | 0.031 |
Weighted residual factors for significantly intense reflections | 0.0697 |
Weighted residual factors for all reflections included in the refinement | 0.0742 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.048 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
Revision | Date | Message | Files |
---|---|---|---|
252320 (current) | 2020-05-23 | cif/ hkl/ Adding structures of 2243406 via cif-deposit CGI script. |
2243406.cif 2243406.hkl |
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