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Information card for entry 1517580
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| Coordinates | 1517580.cif |
|---|
| Formula | C12 H13 Mn N O5 |
|---|---|
| Calculated formula | C12 H13 Mn N O5 |
| Title of publication | Influential factors on assembly of first-row transition metal coordination polymers |
| Authors of publication | Shi-Yao Yang; Hong-Bo Yuan; Xiao-Bin Xu; Rong-Bin Huang |
| Journal of publication | Inorganica Chimica Acta |
| Year of publication | 2013 |
| Journal volume | 403 |
| Pages of publication | 53 - 62 |
| a | 12.6006 ± 0.0008 Å |
| b | 16.3414 ± 0.001 Å |
| c | 12.6527 ± 0.0008 Å |
| α | 90° |
| β | 107.792 ± 0.001° |
| γ | 90° |
| Cell volume | 2480.7 ± 0.3 Å3 |
| Cell temperature | 297 ± 2 K |
| Ambient diffraction temperature | 297 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0618 |
| Residual factor for significantly intense reflections | 0.0556 |
| Weighted residual factors for significantly intense reflections | 0.1161 |
| Weighted residual factors for all reflections included in the refinement | 0.1194 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.197 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176432 (current) | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries. |
1517580.cif |
| 123526 | 2014-09-08 | cif/ Adding structures of 1517580 via cif-deposit CGI script. |
1517580.cif |
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Users of the data should acknowledge the original authors of the
structural data.