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Information card for entry 4067778
Preview
| Coordinates | 4067778.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C38 H46 Cl8 N2 O2 Rh2 |
|---|---|
| Calculated formula | C38 H46 Cl8 N2 O2 Rh2 |
| SMILES | C12=[O][Rh]3456([c]7([c]6([c]5([c]4([c]37C)C)C)C)C)(N(C1=[O][Rh]1345([c]6([c]5([c]4([c]3([c]16C)C)C)C)C)(N2c1ccc(cc1)C)Cl)c1ccc(cc1)C)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl |
| Title of publication | [2+2] Photodimerization in the Solid State Aided by Molecular Templates of Rectangular Macrocycles Bearing Oxamidato Ligands |
| Authors of publication | Zhang, Wan-Zheng; Han, Ying-Feng; Lin, Yue-Jian; Jin, Guo-Xin |
| Journal of publication | Organometallics |
| Year of publication | 2010 |
| Journal volume | 29 |
| Journal issue | 13 |
| Pages of publication | 2842 |
| a | 8.577 ± 0.003 Å |
| b | 11.861 ± 0.004 Å |
| c | 11.888 ± 0.004 Å |
| α | 98.828 ± 0.004° |
| β | 102.2 ± 0.004° |
| γ | 107.769 ± 0.004° |
| Cell volume | 1094.4 ± 0.6 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 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 | 0.0453 |
| Residual factor for significantly intense reflections | 0.0366 |
| Weighted residual factors for significantly intense reflections | 0.0878 |
| Weighted residual factors for all reflections included in the refinement | 0.0914 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.995 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178568 (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 4/06/77. |
4067778.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4067778.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4067778.cif |
| 34290 | 2012-02-13 | ../uploads/cif-deposit/cod/cif Adding structures of 4067778, 4067779, 4067780, 4067781, 4067782 via cif-deposit CGI script. |
4067778.cif |
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