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Information card for entry 4331459
Preview
Coordinates | 4331459.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | poly-{[tris(mu-pyrimidine-4,6-dicarboxylato)-k2N,O:k2N',O')- hexaacuadigadolinium(III)]tridecahydrate} |
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Formula | C18 H56 Gd2 N6 O31 |
Calculated formula | C18 H6 Gd2 N6 O31 |
Title of publication | Synthetic Control to Achieve Lanthanide(III)/Pyrimidine-4,6-dicarboxylate Compounds by Preventing Oxalate Formation: Structural, Magnetic, and Luminescent Properties |
Authors of publication | Javier Cepeda; Rolindes Balda; Garikoitz Beobide; Oscar Castillo; Joaquín Fernández; Antonio Luque; Sonia Pérez-Yáñez; Pascual Román |
Journal of publication | Inorganic Chemistry |
Year of publication | 2012 |
Journal volume | 51 |
Pages of publication | 7875 - 7888 |
a | 22.577 ± 0.006 Å |
b | 11.905 ± 0.002 Å |
c | 14.423 ± 0.006 Å |
α | 90° |
β | 91.35 ± 0.03° |
γ | 90° |
Cell volume | 3876 ± 2 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
Hermann-Mauguin space group symbol | P21/c(0\b0)s0 |
Residual factor for all reflections | 0.1504 |
Residual factor for significantly intense reflections | 0.0871 |
Weighted residual factors for significantly intense reflections | 0.1091 |
Weighted residual factors for all reflections included in the refinement | 0.1206 |
Goodness-of-fit parameter for significantly intense reflections | 2.73 |
Goodness-of-fit parameter for all reflections included in the refinement | 2.13 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
179417 (current) | 2016-03-23 | cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/14. |
4331459.cif |
176724 | 2016-02-18 | cif/4/33/ (antanas@echidna.ibt.lt) Setting svn:keywords property for entries 4331457-4331463. |
4331459.cif |
85317 | 2013-05-07 | Adding modulated structures |
4331459.cif |
All data in the COD and the database itself are dedicated to the
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Users of the data should acknowledge the original authors of the
structural data.