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Information card for entry 4320475
Preview
| Coordinates | 4320475.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C78 H68 Fe3 Hg4 N2 O14 P4 |
|---|---|
| Calculated formula | C78 H68 Fe3 Hg4 N2 O14 P4 |
| SMILES | C1(=O)[Fe]2(C#[O])(C#[O])([Hg]31[Fe]1(C#[O])(C#[O])([P](c4[n]3c([P]2(c2ccccc2)c2ccccc2)ccc4)(c2ccccc2)c2ccccc2)[P](c2[n]3c([P](c4ccccc4)(c4ccccc4)[Fe]4(C(=O)[Hg]134)(C#[O])(C#[O])[Hg]1OC(=[O]1)C)ccc2)(c1ccccc1)c1ccccc1)[Hg]1OC(=[O]1)C.O1CCCC1.O1CCCC1 |
| Title of publication | 2,6-Bis(diphenylphosphino)pyridine-Bridged Hetero-Polynuclear Complexes Consolidated by Fe\ρightarrowM (M = Ag, Hg) Dative Bonding |
| Authors of publication | Hai-Bin Song; Zheng-Zhi Zhang; Thomas C. W. Mak |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2001 |
| Journal volume | 40 |
| Pages of publication | 5928 - 5933 |
| a | 22.244 ± 0.003 Å |
| b | 14.4189 ± 0.0017 Å |
| c | 25.38 ± 0.003 Å |
| α | 90° |
| β | 106.59 ± 0.002° |
| γ | 90° |
| Cell volume | 7801.4 ± 1.7 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0519 |
| Residual factor for significantly intense reflections | 0.0318 |
| Weighted residual factors for significantly intense reflections | 0.0683 |
| Weighted residual factors for all reflections included in the refinement | 0.0738 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.957 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179307 (current) | 2016-03-23 | cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/04. |
4320475.cif |
| 120105 | 2014-07-12 | Adding DOIs to range 4/32 structures. | 4320475.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4320475.cif |
| 17671 | 2011-04-09 | ../uploads/cif-deposit/cod/cif Adding structures of 4320475 via cif-deposit CGI script. |
4320475.cif |
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