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Information card for entry 7017693
Preview
| Coordinates | 7017693.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C23 H27 N2 Ni P |
|---|---|
| Calculated formula | C23 H27 N2 Ni P |
| SMILES | C[Ni]12N(c3c(cccc3)[P]2(c2ccccc2)c2ccccc2)CC[N]1(C)C |
| Title of publication | Nickel complexes incorporating an amido phosphine chelate with a pendant amine arm: synthesis, structure, and catalytic Kumada coupling. |
| Authors of publication | Liang, Lan-Chang; Lee, Wei-Ying; Hung, Yu-Ting; Hsiao, Yi-Chen; Cheng, Liang-Chien; Chen, Wei-Chen |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2012 |
| Journal volume | 41 |
| Journal issue | 4 |
| Pages of publication | 1381 - 1388 |
| a | 10.3899 ± 0.0003 Å |
| b | 10.5707 ± 0.0003 Å |
| c | 11.3703 ± 0.0005 Å |
| α | 102.504 ± 0.001° |
| β | 92.234 ± 0.002° |
| γ | 117.474 ± 0.002° |
| Cell volume | 1067.67 ± 0.07 Å3 |
| Cell temperature | 200 ± 2 K |
| Ambient diffraction temperature | 200 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1004 |
| Residual factor for significantly intense reflections | 0.052 |
| Weighted residual factors for significantly intense reflections | 0.1295 |
| Weighted residual factors for all reflections included in the refinement | 0.1883 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.117 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179880 (current) | 2016-03-25 | cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/76. |
7017693.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7017693.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7017693.cif |
| 33391 | 2012-02-12 | ../uploads/cif-deposit/cod/cif Adding structures of 7017691, 7017692, 7017693, 7017694, 7017695, 7017696 via cif-deposit CGI script. |
7017693.cif |
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Users of the data should acknowledge the original authors of the
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