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Information card for entry 4507204
Preview
| Coordinates | 4507204.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C13 H21 Cu3 N6 O8.5 |
|---|---|
| Calculated formula | C13 H21 Cu3 N6 O8.5 |
| Title of publication | Coordination Polymers Based on the Trinuclear Triangular Secondary Building Unit [Cu3(μ3-OH)(μ-pz)3]2+(pz = pyrazolate) and Succinate Anion |
| Authors of publication | Di Nicola, Corrado; Forlin, Enrico; Garau, Federica; Gazzano, Massimo; Lanza, Arianna; Monari, Magda; Nestola, Fabrizio; Pandolfo, Luciano; Pettinari, Claudio; Zorzi, Alberto; Zorzi, Federico |
| Journal of publication | Crystal Growth & Design |
| Year of publication | 2013 |
| Journal volume | 13 |
| Journal issue | 1 |
| Pages of publication | 126 |
| a | 26.625 ± 0.007 Å |
| b | 26.625 ± 0.007 Å |
| c | 20.024 ± 0.007 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 12293 ± 6 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 148 |
| Hermann-Mauguin space group symbol | R -3 :H |
| Hall space group symbol | -R 3 |
| Residual factor for all reflections | 0.1307 |
| Residual factor for significantly intense reflections | 0.066 |
| Weighted residual factors for significantly intense reflections | 0.1613 |
| Weighted residual factors for all reflections included in the refinement | 0.1725 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.952 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 188994 (current) | 2016-12-07 | cif/4/50/72/ Marking attached hydrogens (2) for each O?W atom of COD entry 4507204 thus achieving the agreement between declared and calculated summary formulae. |
4507204.cif |
| 176467 | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4. |
4507204.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4507204.cif |
| 73848 | 2013-02-21 | cif/ Adding structures of 4507204 via cif-deposit CGI script. |
4507204.cif |
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Users of the data should acknowledge the original authors of the
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