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Information card for entry 4309809
Preview
| Coordinates | 4309809.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C46 H60 Mg2 N4 O6 |
|---|---|
| Calculated formula | C46 H60 Mg2 N4 O6 |
| SMILES | C1(=[N](c2ccccc2OC)[Mg]2(N(C(=C1)C)c1ccccc1OC)[O](C(C)(C)C)[Mg]1([N](=C(C=C(C)N1c1ccccc1OC)C)c1ccccc1OC)[O]2C(C)(C)C)C |
| Title of publication | Comparative Study of the Coordination Chemistry and Lactide Polymerization of Alkoxide and Amide Complexes of Zinc and Magnesium with a β-Diiminato Ligand Bearing Ether Substituents |
| Authors of publication | Malcolm H. Chisholm; Judith C. Gallucci; Khamphee Phomphrai |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2005 |
| Journal volume | 44 |
| Pages of publication | 8004 - 8010 |
| a | 11.219 ± 0.001 Å |
| b | 19.481 ± 0.003 Å |
| c | 11.319 ± 0.001 Å |
| α | 90° |
| β | 109.44 ± 0.01° |
| γ | 90° |
| Cell volume | 2332.8 ± 0.5 Å3 |
| Cell temperature | 200 ± 2 K |
| Ambient diffraction temperature | 200 ± 2 K |
| Number of distinct elements | 5 |
| 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 | 0.0826 |
| Residual factor for significantly intense reflections | 0.0513 |
| Weighted residual factors for all reflections | 0.1457 |
| Weighted residual factors for all reflections included in the refinement | 0.1257 |
| Goodness-of-fit parameter for all reflections | 1.02 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.064 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179136 (current) | 2016-03-23 | cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/98. |
4309809.cif |
| 120081 | 2014-07-12 | Adding DOIs to range 4/30 structures. | 4309809.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4309809.cif |
| 1526 | 2010-09-26 | cif/4/ Adding new CIFs from Inorg. Chem. 2005 deposited via Web deposition site to the COD test database (and transferede to the main COD database after renaming). |
4309809.cif |
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Users of the data should acknowledge the original authors of the
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