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Information card for entry 4320351
Preview
| Coordinates | 4320351.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C128 H84 Cd6 O4 Pt4 |
|---|---|
| Calculated formula | C128 H84 Cd6 O4 Pt4 |
| SMILES | [C]1(#Cc2ccccc2)[Cd]2345[C](#Cc6ccccc6)[Pt]61[C]1#[C](c7ccccc7)[Cd]7891[OH]2[Cd]12%10%11[C](#Cc%12ccccc%12)[Pt]([C]1#Cc1ccccc1)([C]5#[C]3c1cccc1)[C]1#[C](c3ccccc3)[Cd]35%121[OH]2[Cd]12%13([C](#Cc%14ccccc%14)[Pt]([C]1#Cc1ccccc1)([C]8#[C]9c1ccccc1)[C]%10#[C]%11c1ccccc1)[OH]7[Cd]17([C]6#[C]1c1ccccc1)([OH]43)[C](#Cc1ccccc1)[Pt]([C]7#Cc1ccccc1)([C]%12#[C]5c1ccccc1)[C]2#[C]%13c1ccccc1 |
| Title of publication | Luminescent Alkynyl Platinum-Cadmium Complexes: Structural Characterization of an Unusual Decanuclear Cluster [Pt4Cd6(C\τbCPh)4(μ-C\τbCPh)12(μ3-OH)4] |
| Authors of publication | Juan Forniés; Julio Gómez; Elena Lalinde; M. Teresa Moreno |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2001 |
| Journal volume | 40 |
| Pages of publication | 5415 - 5419 |
| a | 16.105 ± 0.002 Å |
| b | 16.105 ± 0.002 Å |
| c | 20.25 ± 0.004 Å |
| α | 90 ± 0.001° |
| β | 90 ± 0.001° |
| γ | 90 ± 0.001° |
| Cell volume | 5252.3 ± 1.4 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 114 |
| Hermann-Mauguin space group symbol | P -4 21 c |
| Hall space group symbol | P -4 2n |
| Residual factor for all reflections | 0.0797 |
| Residual factor for significantly intense reflections | 0.0696 |
| Weighted residual factors for significantly intense reflections | 0.1867 |
| Weighted residual factors for all reflections included in the refinement | 0.2038 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.212 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179306 (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 4/32/03. |
4320351.cif |
| 120105 | 2014-07-12 | Adding DOIs to range 4/32 structures. | 4320351.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4320351.cif |
| 17255 | 2011-04-06 | ../uploads/cif-deposit/cod/cif Adding structures of 4320351 via cif-deposit CGI script. |
4320351.cif |
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