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Information card for entry 4329652
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Coordinates | 4329652.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C7 H10 In3 N Se5 |
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Calculated formula | C7 H10 In3 N Se5 |
Title of publication | [C7H10N][In3Se5]: A Layered Selenide with Two Indium Coordination Environments |
Authors of publication | Sarah J. Ewing; Anthony V. Powell; Paz Vaqueiro |
Journal of publication | Inorganic Chemistry |
Year of publication | 2012 |
Journal volume | 51 |
Pages of publication | 7404 - 7409 |
a | 3.999 ± 0.0004 Å |
b | 16.7858 ± 0.0015 Å |
c | 23.93 ± 0.002 Å |
α | 90° |
β | 94.728 ± 0.004° |
γ | 90° |
Cell volume | 1600.9 ± 0.3 Å3 |
Cell temperature | 293 K |
Ambient diffraction temperature | 293 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.1031 |
Residual factor for significantly intense reflections | 0.0655 |
Weighted residual factors for all reflections | 0.0545 |
Weighted residual factors for significantly intense reflections | 0.0482 |
Weighted residual factors for all reflections included in the refinement | 0.0465 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.0579 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
176467 (current) | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4. |
4329652.cif |
78709 | 2013-04-02 | cif/ Adding structures of 4329652 via cif-deposit CGI script. |
4329652.cif |
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Users of the data should acknowledge the original authors of the
structural data.