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Information card for entry 4123364
Preview
| Coordinates | 4123364.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C32 H58 P2 Pt Sn V |
|---|---|
| Calculated formula | C32 H58 P2 Pt Sn V |
| SMILES | [Pt]1([Sn]([c]23[V]456789%10%11%12([cH]([cH]9[cH]27)[cH]%10[cH]38)[cH]2[c]14[cH]6[cH]%12[cH]%11[cH]52)(C(C)(C)C)C(C)(C)C)([P](CC)(CC)CC)[P](CC)(CC)CC |
| Title of publication | A paramagnetic heterobimetallic polymer: synthesis, reactivity, and ring-opening polymerization of tin-bridged homo- and heteroleptic vanadoarenophanes. |
| Authors of publication | Braunschweig, Holger; Damme, Alexander; Demeshko, Serhiy; Dück, Klaus; Kramer, Thomas; Krummenacher, Ivo; Meyer, Franc; Radacki, Krzysztof; Stellwag-Konertz, Sascha; Whittell, George R. |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2015 |
| Journal volume | 137 |
| Journal issue | 4 |
| Pages of publication | 1492 - 1500 |
| a | 21.9178 ± 0.0014 Å |
| b | 18.6844 ± 0.0011 Å |
| c | 17.974 ± 0.0011 Å |
| α | 90° |
| β | 109.179 ± 0.003° |
| γ | 90° |
| Cell volume | 6952.2 ± 0.7 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/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0709 |
| Residual factor for significantly intense reflections | 0.0402 |
| Weighted residual factors for significantly intense reflections | 0.0818 |
| Weighted residual factors for all reflections included in the refinement | 0.0965 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.869 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179035 (current) | 2016-03-22 | cif/4/12/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/12/33. |
4123364.cif |
| 132875 | 2015-03-04 | cif/ Updating files of 4123362, 4123363, 4123364, 4123365 Original log message: Adding full bibliography for 4123362--4123365.cif. |
4123364.cif |
| 130586 | 2015-02-04 | cif/ Adding structures of 4123362, 4123363, 4123364, 4123365 via cif-deposit CGI script. |
4123364.cif |
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