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Information card for entry 4070858
Preview
| Coordinates | 4070858.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | tris-[ethynylphenyl-bis-(triethylphosphine)Platinum iodide]amine |
|---|---|
| Formula | C60 H102 I3 N P6 Pt3 |
| Calculated formula | C60 H92 I3 N P6 Pt3 |
| SMILES | [Pt](I)([P](CC)(CC)CC)([P](CC)(CC)CC)C#Cc1ccc(N(c2ccc(C#C[Pt](I)([P](CC)(CC)CC)[P](CC)(CC)CC)cc2)c2ccc(cc2)C#C[Pt](I)([P](CC)(CC)CC)[P](CC)(CC)CC)cc1 |
| Title of publication | Self-Assembly of a Nanoscopic Prism via a New Organometallic Pt3Acceptor and Its Fluorescent Detection of Nitroaromatics |
| Authors of publication | Ghosh, Sushobhan; Mukherjee, Partha Sarathi |
| Journal of publication | Organometallics |
| Year of publication | 2008 |
| Journal volume | 27 |
| Journal issue | 3 |
| Pages of publication | 316 |
| a | 16.944 ± 0.005 Å |
| b | 17.295 ± 0.005 Å |
| c | 25.961 ± 0.007 Å |
| α | 90° |
| β | 101.622 ± 0.007° |
| γ | 90° |
| Cell volume | 7452 ± 4 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.2053 |
| Residual factor for significantly intense reflections | 0.0701 |
| Weighted residual factors for significantly intense reflections | 0.145 |
| Weighted residual factors for all reflections included in the refinement | 0.1992 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.919 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178597 (current) | 2016-03-21 | cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/08. |
4070858.cif |
| 171491 | 2015-12-13 | cif/ (antanas@echidna.ibt.lt) Removing surrounding qoutes ("'") from the _chemical_name_systematic tag values in multiple entries in range 4. |
4070858.cif |
| 120075 | 2014-07-11 | Adding DOIs to range 4/07 structures. | 4070858.cif |
| 47256 | 2012-03-23 | cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories. |
4070858.cif |
| 42780 | 2012-03-13 | ../uploads/cif-deposit/cod/cif Adding structures of 4070858 via cif-deposit CGI script. |
4070858.cif |
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