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Information card for entry 4341494
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| Coordinates | 4341494.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | Poly[tetrakis-[1,3-di(1,2,4-triazol-4-yl)adamantane]-dicopper(II) beta-octamolybdate(VI)] |
|---|---|
| Formula | C56 H72 Cu2 Mo8 N24 O26 |
| Calculated formula | C56 H72 Cu2 Mo8 N24 O26 |
| Title of publication | Triazolyl-based copper-molybdate hybrids: from composition space diagram to magnetism and catalytic performance. |
| Authors of publication | Senchyk, Ganna A.; Lysenko, Andrey B.; Babaryk, Artem A.; Rusanov, Eduard B.; Krautscheid, Harald; Neves, Patrícia; Valente, Anabela A.; Gonçalves, Isabel S; Krämer, Karl W; Liu, Shi-Xia; Decurtins, Silvio; Domasevitch, Konstantin V. |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2014 |
| Journal volume | 53 |
| Journal issue | 19 |
| Pages of publication | 10112 - 10121 |
| a | 12.1133 ± 0.0004 Å |
| b | 12.7626 ± 0.0005 Å |
| c | 12.9724 ± 0.0005 Å |
| α | 83.839 ± 0.003° |
| β | 67.379 ± 0.003° |
| γ | 81.747 ± 0.003° |
| Cell volume | 1829.06 ± 0.12 Å3 |
| Cell temperature | 213 ± 2 K |
| Ambient diffraction temperature | 213 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1223 |
| Residual factor for significantly intense reflections | 0.0605 |
| Weighted residual factors for significantly intense reflections | 0.103 |
| Weighted residual factors for all reflections included in the refinement | 0.119 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.903 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 288505 (current) | 2023-12-22 | Corrected misspelt data names in multiple entries using the 'cif_correct_tags' program and a data name replacement file from cod-tools revision 9880. This change affected only the misspelt variants of the '_iucr_refine_instructions_details' data name. |
4341494.cif |
| 179517 | 2016-03-23 | cif/4/34/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/34/14. |
4341494.cif |
| 126695 | 2014-11-10 | cif/ Adding structures of 4341494, 4341495, 4341496, 4341497 via cif-deposit CGI script. |
4341494.cif |
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