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Information card for entry 2023018
Preview
Coordinates | 2023018.cif |
---|---|
Structure factors | 2023018.hkl |
Original IUCr paper | HTML |
Chemical name | Poly[[triaquabis(μ~4~-phthalato)(μ~3~-pyridine-2,5-dicarboxylato)dipraseodymium] monohydrate] |
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Formula | C23 H19 N O16 Pr2 |
Calculated formula | C23 H19 N O16 Pr2 |
Title of publication | Crystal structure and characterization of a new lanthanide coordination polymer, [Pr<sub>2</sub>(pydc)(phth)<sub>2</sub>(H<sub>2</sub>O)<sub>3</sub>]·H<sub>2</sub>O. |
Authors of publication | Yotnoi, Bunlawee; Rujiwatra, Apinpus |
Journal of publication | Acta crystallographica. Section E, Crystallographic communications |
Year of publication | 2024 |
Journal volume | 80 |
Journal issue | Pt 2 |
Pages of publication | 228 - 231 |
a | 27.4898 ± 0.0004 Å |
b | 5.9436 ± 0.0001 Å |
c | 32.0473 ± 0.0005 Å |
α | 90° |
β | 93.854 ± 0.001° |
γ | 90° |
Cell volume | 5224.32 ± 0.14 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
Space group number | 15 |
Hermann-Mauguin space group symbol | I 1 2/a 1 |
Hall space group symbol | -I 2ya |
Residual factor for all reflections | 0.0361 |
Residual factor for significantly intense reflections | 0.0314 |
Weighted residual factors for significantly intense reflections | 0.0778 |
Weighted residual factors for all reflections included in the refinement | 0.0807 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.046 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
Revision | Date | Message | Files |
---|---|---|---|
290327 (current) | 2024-03-05 | cif/ Updating files of 2023018 Original log message: Adding full bibliography for 2023018.cif. |
2023018.cif 2023018.hkl |
289255 | 2024-02-01 | cif/ hkl/ Adding structures of 2023018 via cif-deposit CGI script. |
2023018.cif 2023018.hkl |
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Users of the data should acknowledge the original authors of the
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