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Information card for entry 4339998
Preview
| Coordinates | 4339998.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C43 H23 F15 N4 Sn |
|---|---|
| Calculated formula | C43 H23 F15 N4 Sn |
| SMILES | [Sn]123([n]4c5ccc4=C(c4n1c(cc4)c1n2c(cc1)C(=c1n3c(cc1)=C5c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F)C.CCCCC |
| Title of publication | Synthesis and Reactivity Studies of a Tin(II) Corrole Complex. |
| Authors of publication | Yun, Lin; Vazquez-Lima, Hugo; Fang, Huayi; Yao, Zhengmin; Geisberger, Georg; Dietl, Christian; Ghosh, Abhik; Brothers, Penelope J.; Fu, Xuefeng |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2014 |
| Journal volume | 53 |
| Journal issue | 13 |
| Pages of publication | 7047 - 7054 |
| a | 14.946 ± 0.003 Å |
| b | 9.5085 ± 0.0004 Å |
| c | 15.1008 ± 0.0009 Å |
| α | 90° |
| β | 115.749 ± 0.002° |
| γ | 90° |
| Cell volume | 1932.9 ± 0.4 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.0306 |
| Residual factor for significantly intense reflections | 0.0301 |
| Weighted residual factors for significantly intense reflections | 0.0742 |
| Weighted residual factors for all reflections included in the refinement | 0.0747 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.079 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179502 (current) | 2016-03-23 | cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/99. |
4339998.cif |
| 121171 | 2014-08-05 | cif/ Updating files of 4339997, 4339998, 4339999 Original log message: Adding full bibliography for 4339997--4339999.cif. |
4339998.cif |
| 117884 | 2014-06-19 | cif/ Adding structures of 4339997, 4339998, 4339999 via cif-deposit CGI script. |
4339998.cif |
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Users of the data should acknowledge the original authors of the
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