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Information card for entry 4114361
Preview
| Coordinates | 4114361.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C96 H152 Cl8 O8 P8 Pt4 |
|---|---|
| Calculated formula | C96 H152 Cl8 O8 P8 Pt4 |
| Title of publication | Facile Self-Assembly of Predesigned Neutral 2D Pt-Macrocycles via a New Class of Rigid Oxygen Donor Linkers |
| Authors of publication | Neeladri Das; Partha Sarathi Mukherjee; Atta M. Arif; Peter J. Stang |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2003 |
| Journal volume | 125 |
| Pages of publication | 13950 - 13951 |
| a | 11.872 ± 0.0002 Å |
| b | 12.8355 ± 0.0003 Å |
| c | 20.9817 ± 0.0004 Å |
| α | 79.8348 ± 0.001° |
| β | 74.1654 ± 0.0011° |
| γ | 73.5959 ± 0.0012° |
| Cell volume | 2933.55 ± 0.1 Å3 |
| Cell temperature | 150 ± 1 K |
| Ambient diffraction temperature | 150 ± 1 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 | 0.0683 |
| Residual factor for significantly intense reflections | 0.0465 |
| Weighted residual factors for significantly intense reflections | 0.1191 |
| Weighted residual factors for all reflections included in the refinement | 0.1332 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.041 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301833 (current) | 2025-08-20 | Add cross-references to PubChem compounds in COD range 4/11/ Each referenced PubChem compound corresponds to the full crystal structure. |
4114361.cif |
| 178914 | 2016-03-22 | cif/4/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/11/43. |
4114361.cif |
| 120077 | 2014-07-12 | Adding DOIs to range 4/11 structures. | 4114361.cif |
| 67666 | 2012-10-02 | cif/ Adding structures of 4114361 via cif-deposit CGI script. |
4114361.cif |
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Users of the data should acknowledge the original authors of the
structural data.