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Information card for entry 2228985
Preview
| Coordinates | 2228985.cif |
|---|---|
| Structure factors | 2228985.hkl |
| Original IUCr paper | HTML |
| Chemical name | MethanolBis{2-methoxy-6-[(4-methylphenyl)iminiomethyl]phenolato- κ^2^<i>O</i>^1^,<i>O</i>^2^}tris(nitrato-κ^2^<i>O</i>,<i>O</i>')samarium(III) |
|---|---|
| Formula | C31 H34 N5 O14 Sm |
| Calculated formula | C31 H34 N5 O14 Sm |
| Title of publication | Bis{2-methoxy-6-[(4-methylphenyl)iminiomethyl]phenolato-κ^2^<i>O</i>^1^,<i>O</i>^2^}tris(nitrato-κ^2^<i>O</i>,<i>O</i>')methanolsamarium(III) |
| Authors of publication | Guo, Hang-Ming |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2011 |
| Journal volume | 67 |
| Journal issue | 2 |
| Pages of publication | m184 - m185 |
| a | 7.8547 ± 0.001 Å |
| b | 14.6893 ± 0.0019 Å |
| c | 16.59 ± 0.002 Å |
| α | 73.402 ± 0.008° |
| β | 85.738 ± 0.007° |
| γ | 79.23 ± 0.007° |
| Cell volume | 1801.6 ± 0.4 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0514 |
| Residual factor for significantly intense reflections | 0.0431 |
| Weighted residual factors for significantly intense reflections | 0.1184 |
| Weighted residual factors for all reflections included in the refinement | 0.1226 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.046 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181210 (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 2/22/89. |
2228985.cif 2228985.hkl |
| 176789 | 2016-02-20 | cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/22. |
2228985.cif 2228985.hkl |
| 120072 | 2014-07-11 | Adding DOIs to range 2 structures. | 2228985.cif 2228985.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. | 2228985.cif 2228985.hkl |
| 26848 | 2011-09-28 | cif/2/, hkl/2/, html/ Reorganising CIFs of the range 2* into the "prefix-directory" tree. |
2228985.cif 2228985.hkl |
| 14261 | 2011-03-09 | Adding the Fobs data for the recenty deposited IUCr structrures. | 2228985.cif 2228985.hkl |
| 12003 | 2011-03-04 | ../uploads/cif-deposit/cod/cif Adding structures of 2228985 via cif-deposit CGI script. |
2228985.cif |
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Users of the data should acknowledge the original authors of the
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