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Information card for entry 7005536
Preview
Coordinates | 7005536.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | As2 Fe2 H2 Li2 O10 |
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Calculated formula | As2 Fe2 H2 Li2 O10 |
Title of publication | Iron arsenate frameworks. |
Authors of publication | Wiggin, Seth B.; Hughes, Robert W.; Price, Daniel J.; Weller, Mark T. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2007 |
Journal issue | 27 |
Pages of publication | 2935 - 2941 |
a | 5.2652 ± 0.0003 Å |
b | 5.4841 ± 0.0003 Å |
c | 7.3932 ± 0.0004 Å |
α | 110.669 ± 0.003° |
β | 105.318 ± 0.003° |
γ | 98.16 ± 0.004° |
Cell volume | 185.984 ± 0.019 Å3 |
Cell temperature | 120 ± 2 K |
Ambient diffraction temperature | 120 ± 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 | 0.0316 |
Residual factor for significantly intense reflections | 0.027 |
Weighted residual factors for significantly intense reflections | 0.0662 |
Weighted residual factors for all reflections included in the refinement | 0.0686 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.956 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
176453 (current) | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7. |
7005536.cif |
120443 | 2014-07-15 | Adding 17924 DOIs guessed from source file names. | 7005536.cif |
35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7005536.cif |
1186 | 2010-06-03 | Adding CIFs from Chem-Comm-2010_20-22/ and Dalton-Trans-2007/ processing. | 7005536.cif |
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Users of the data should acknowledge the original authors of the
structural data.