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CIF Information Card
Information card for 2015251
2015250 << 2015251 >> 2015252Preview
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Coordinates |
2015251.cif |
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Original IUCr paper |
HTML |
Structure parameters
| Chemical name | diaqua(pyridine-2-carboxylato)(pyridine-2,6-dicarboxylato)indium(II) trihydrate, [In(C~6~H~4~NO~2~)(C~7~H~3~NO~4~)(H~2~O)~2~].3H~2~O |
| Formula | - C13 H17 In N2 O11 - |
| Calculated formula | - C13 H17 In N2 O11 - |
| Title of publication | An indium(III)‒water chain based on an unusual acyclic water pentamer |
| Authors of publication | Chun-Bo Liu; Guang-Bo Che; Chuan-Bi Li; Yun-Cheng Cui |
| Journal of publication | Acta Crystallographica, Section C |
| Year of publication | 2006 |
| Journal volume | 62 |
| Journal issue | 4 |
| Pages of publication | m153 - m155 |
| a | 8.0818 ± 0.0016 Å |
| b | 11.129 ± 0.002 Å |
| c | 11.626 ± 0.002 Å |
| α | 67.56 ± 0.03° |
| β | 74.48 ± 0.03° |
| γ | 69.55 ± 0.03° |
| Cell volume | 894.6 ± 0.4 Å3 |
| Cell temperature | 292 ± 2 K |
| Ambient diffraction temperature | 292 ± 2 K |
| Number of distinct elements | 5 |
| Hermann-Mauguin symmetry space group | P -1 |
| Hall symmetry space group | -P 1 |
| Residual factor for all reflections | 0.0347 |
| Residual factor for observed reflections | 0.0276 |
| Weighted residual factors for the observed reflections | 0.0549 |
| Weighted residual factors for all reflections included in the refinement | 0.0566 |
| Goodness-of-fit parameter for observed reflections | 1.008 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |