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Information card for entry 4123362
Preview
| Coordinates | 4123362.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C20 H28 Sn V |
|---|---|
| Calculated formula | C20 H28 Sn V |
| SMILES | [V]123456789%10%11[c]%12([Sn](C(C)(C)C)([c]%136[cH]7[cH]8[cH]9[cH]%10[cH]%11%13)C(C)(C)C)[cH]1[cH]2[cH]3[cH]4[cH]5%12 |
| 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 | 12.5094 ± 0.0012 Å |
| b | 9.8617 ± 0.0009 Å |
| c | 15.3826 ± 0.0015 Å |
| α | 90° |
| β | 107.849 ± 0.004° |
| γ | 90° |
| Cell volume | 1806.3 ± 0.3 Å3 |
| Cell temperature | 108 ± 2 K |
| Ambient diffraction temperature | 108 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0124 |
| Residual factor for significantly intense reflections | 0.0118 |
| Weighted residual factors for significantly intense reflections | 0.031 |
| Weighted residual factors for all reflections included in the refinement | 0.0313 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.122 |
| 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. |
4123362.cif |
| 132875 | 2015-03-04 | cif/ Updating files of 4123362, 4123363, 4123364, 4123365 Original log message: Adding full bibliography for 4123362--4123365.cif. |
4123362.cif |
| 130586 | 2015-02-04 | cif/ Adding structures of 4123362, 4123363, 4123364, 4123365 via cif-deposit CGI script. |
4123362.cif |
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