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Information card for entry 4068832
Preview
| Coordinates | 4068832.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C50 H68 N4 O Sn2 Zr |
|---|---|
| Calculated formula | C50 H68 N4 O Sn2 Zr |
| SMILES | [Zr]12345678([Sn](c9c(cccc9)CN(C)C)c9c(cccc9)CN(C)C)([Sn](c9c(cccc9)CN(C)C)c9c(cccc9)CN(C)C)([cH]9[cH]1[cH]2[cH]3[cH]49)[cH]1[cH]5[cH]6[cH]7[cH]81.CCOCC |
| Title of publication | Reactions of C,N-chelated Tin(II) and Lead(II) Compounds with Zirconocene Dichloride Derivatives |
| Authors of publication | Bareš, Josef; Richard, Philippe; Meunier, Philippe; Pirio, Nadine; Padělková, Zdeňka; Černošek, Zdeněk; Císařová, Ivana; Růžička, Aleš |
| Journal of publication | Organometallics |
| Year of publication | 2009 |
| Journal volume | 28 |
| Journal issue | 10 |
| Pages of publication | 3105 |
| a | 10.5104 ± 0.0006 Å |
| b | 11.8483 ± 0.0007 Å |
| c | 20.4351 ± 0.0017 Å |
| α | 86.818 ± 0.005° |
| β | 87.759 ± 0.006° |
| γ | 73.511 ± 0.005° |
| Cell volume | 2435.6 ± 0.3 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 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 | 0.0574 |
| Residual factor for significantly intense reflections | 0.0265 |
| Weighted residual factors for significantly intense reflections | 0.0414 |
| Weighted residual factors for all reflections included in the refinement | 0.0434 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.802 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178578 (current) | 2016-03-21 | cif/4/06/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/06/88. |
4068832.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4068832.cif |
| 40002 | 2012-03-07 | ../uploads/cif-deposit/cod/cif Adding structures of 4068832, 4068833 via cif-deposit CGI script. |
4068832.cif |
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Users of the data should acknowledge the original authors of the
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