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Information card for entry 2228874
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| Coordinates | 2228874.cif |
|---|---|
| Structure factors | 2228874.hkl |
| Original IUCr paper | HTML |
| Common name | [Rh(Htren)Cl~3]Cl*0.5H~2O |
|---|---|
| Chemical name | <i>fac</i>-{2-[Bis(2-aminoethyl)amino]ethanaminium}trichloridorhodium(III) chloride hemihydrate |
| Formula | C6 H20 Cl4 N4 O0.5 Rh |
| Calculated formula | C6 H20 Cl4 N4 O0.5 Rh |
| Title of publication | <i>fac</i>-{2-[Bis(2-aminoethyl)amino]ethanaminium}trichloridorhodium(III) chloride hemihydrate |
| Authors of publication | Kutzky, Barbara; Neis, Christian; Hegetschweiler, Kaspar |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2011 |
| Journal volume | 67 |
| Journal issue | 1 |
| Pages of publication | m92 - m93 |
| a | 13.8022 ± 0.0006 Å |
| b | 14.1954 ± 0.0005 Å |
| c | 13.6208 ± 0.0005 Å |
| α | 90° |
| β | 91.196 ± 0.001° |
| γ | 90° |
| Cell volume | 2668.11 ± 0.18 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| 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 | 0.0271 |
| Residual factor for significantly intense reflections | 0.0252 |
| Weighted residual factors for significantly intense reflections | 0.0637 |
| Weighted residual factors for all reflections included in the refinement | 0.065 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.178 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181209 (current) | 2016-04-03 | hkl/2/22/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/22/88. |
2228874.cif 2228874.hkl |
| 176435 | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries from ranges 1, 2. |
2228874.cif 2228874.hkl |
| 120072 | 2014-07-11 | Adding DOIs to range 2 structures. | 2228874.cif 2228874.hkl |
| 88064 | 2013-08-29 | Adding _cod_database_fobs_code data item to all COD CIFs that have Fobs deposited and did not have this data item yet. | 2228874.cif 2228874.hkl |
| 26848 | 2011-09-28 | cif/2/, hkl/2/, html/ Reorganising CIFs of the range 2* into the "prefix-directory" tree. |
2228874.cif 2228874.hkl |
| 11387 | 2011-02-15 | hkl/: Adding Reflection data for the recently deposited IUCr-originating structures. | 2228874.cif 2228874.hkl |
| 10116 | 2011-02-10 | ../uploads/cif-deposit/cod/cif Adding structures of 2228874 via cif-deposit CGI script. |
2228874.cif |
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Users of the data should acknowledge the original authors of the
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