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Information card for entry 8103043
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Coordinates | 8103043.cif |
---|
Formula | H78 Mg5 N2 O77 W12 |
---|---|
Calculated formula | H78 Mg5 N2 O77 W12 |
Title of publication | Crystal structure of diammonium hexaaquamagnesium icosaaqua-tetramagnesium-hexakis(m3-oxo)-hexacosakis(m2-oxo)-decaoxo-dodecatungsten octahydrate, (NH4)2[Mg(H2O)6][Mg4(H2O)20W12O42] · 8H2O |
Authors of publication | Hai-Xing Liu |
Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
Year of publication | 2010 |
Journal volume | 225 |
Journal issue | 2 |
Pages of publication | 233 |
a | 12.5454 ± 0.0012 Å |
b | 13.344 ± 0.002 Å |
c | 13.6508 ± 0.0015 Å |
α | 91.266 ± 0.002° |
β | 116.702 ± 0.003° |
γ | 111.9 ± 0.002° |
Cell volume | 1843.9 ± 0.4 Å3 |
Cell temperature | 291 ± 2 K |
Ambient diffraction temperature | 291 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0872 |
Residual factor for significantly intense reflections | 0.0547 |
Weighted residual factors for significantly intense reflections | 0.1355 |
Weighted residual factors for all reflections included in the refinement | 0.1524 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.011 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
211175 (current) | 2018-09-26 | cif/ Removing _chemical_name_systematic and _chemical_name_common data items with placeholder values from 513 entries in range 8. |
8103043.cif |
176728 | 2016-02-18 | cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 8. |
8103043.cif |
35911 | 2012-02-28 | cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree. |
8103043.cif |
13782 | 2011-03-06 | ../uploads/cif-deposit/cod/cif Adding structures of 8103043 via cif-deposit CGI script. |
8103043.cif |
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Users of the data should acknowledge the original authors of the
structural data.