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Information card for entry 4319358
Preview
| Coordinates | 4319358.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | Bis([2.2.2]-cryptand) Platinum-bis(maleonitrilediselenolate) |
|---|---|
| Formula | C44 H72 K2 N8 O12 Pt Se4 |
| Calculated formula | C44 H72 K2 N8 O12 Pt Se4 |
| SMILES | [K]1234567[O]8CC[O]1CC[N]21CC[O]3CC[O]4CC[N]5(CC8)CC[O]6CC[O]7CC1.[Pt]12([Se]C(=C(C#N)[Se]1)C#N)[Se]C(=C(C#N)[Se]2)C#N.[K]1234567[O]8CC[O]1CC[N]21CC[O]3CC[O]4CC[N]5(CC8)CC[O]6CC[O]7CC1 |
| Title of publication | Syntheses and Characterization of the Metal Maleonitrilediselenolates [K([2.2.2]-cryptand)]2[M(Se2C2(CN)2)2] (M = Ni, Pd, Pt) and [Ni(dmf)5Cl]2[Ni(Se2C2(CN)2)2] |
| Authors of publication | Craig C. McLauchlan; Scott D. Robowski; James A. Ibers |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2001 |
| Journal volume | 40 |
| Pages of publication | 1372 - 1375 |
| a | 12.292 ± 0.003 Å |
| b | 15.671 ± 0.003 Å |
| c | 15.569 ± 0.003 Å |
| α | 90° |
| β | 108.59 ± 0.03° |
| γ | 90° |
| Cell volume | 2842.5 ± 1.2 Å3 |
| Cell temperature | 153 ± 2 K |
| Ambient diffraction temperature | 153 ± 2 K |
| Number of distinct elements | 7 |
| 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 | 0.0557 |
| Residual factor for significantly intense reflections | 0.0386 |
| Weighted residual factors for significantly intense reflections | 0.0813 |
| Weighted residual factors for all reflections included in the refinement | 0.084 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.324 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179273 (current) | 2016-03-23 | cif/4/31/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/31/93. |
4319358.cif |
| 120093 | 2014-07-12 | Adding DOIs to range 4/31 structures. | 4319358.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4319358.cif |
| 16090 | 2011-03-20 | ../uploads/cif-deposit/cod/cif Adding structures of 4319358 via cif-deposit CGI script. |
4319358.cif |
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