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Information card for entry 7012407
Preview
| Coordinates | 7012407.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C17 H34 Fe K N5 O4 |
|---|---|
| Calculated formula | C17 H34 Fe K N5 O4 |
| Title of publication | Development of bio-inspired chelates with hydrogen bond donors: synthesis and structure of monomeric metal acetate complexes with intramolecular hydrogen bondsBased on the presentation given at Dalton Discussion No. 5, 10?12th April 2003, Noordwijkerhout, The Netherlands. |
| Authors of publication | Zart, Matthew K.; Sorrell, Thomas N.; Powell, Douglas; Borovik, A. S. |
| Journal of publication | Dalton Transactions |
| Year of publication | 2003 |
| Journal issue | 10 |
| Pages of publication | 1986 |
| a | 10.4396 ± 0.0006 Å |
| b | 15.1673 ± 0.0009 Å |
| c | 17.0455 ± 0.001 Å |
| α | 70.427 ± 0.002° |
| β | 74.547 ± 0.002° |
| γ | 70.066 ± 0.002° |
| Cell volume | 2355.1 ± 0.2 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 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 | 0.0648 |
| Residual factor for significantly intense reflections | 0.0531 |
| Weighted residual factors for significantly intense reflections | 0.1325 |
| Weighted residual factors for all reflections included in the refinement | 0.1381 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.107 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 213973 (current) | 2019-03-05 | cod/ Removed potentially copyrighted or irrelevant data items from 1289 entries. |
7012407.cif |
| 179828 | 2016-03-25 | cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/24. |
7012407.cif |
| 120443 | 2014-07-15 | Adding 17924 DOIs guessed from source file names. | 7012407.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7012407.cif |
| 3896 | 2010-12-08 | cif/7/ Adding CIFs with data from Dalton-Trans-2004-2000/. |
7012407.cif |
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Users of the data should acknowledge the original authors of the
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