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Information card for entry 7017716
Preview
| Coordinates | 7017716.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C25 H36 F12 N12 P2 Ru |
|---|---|
| Calculated formula | C25 H36 F12 N12 P2 Ru |
| SMILES | [Ru]123(=C4N(c5cccc[n]25)C=CN4CN2C=1N(C=C2)c1ccccn1)([NH2]CC[NH2]3)[NH]=C(C)NCCN.C(#N)C.[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-] |
| Title of publication | Synthesis of ruthenium(II) complexes of tetradentate bis(N-pyridylimidazolylidenyl)methane and their reactivities towards N- donors. |
| Authors of publication | Liu, Xiaolong; Chen, Wanzhi |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2012 |
| Journal volume | 41 |
| Journal issue | 2 |
| Pages of publication | 599 - 608 |
| a | 12.0111 ± 0.0005 Å |
| b | 12.4027 ± 0.0004 Å |
| c | 13.1637 ± 0.0004 Å |
| α | 90.6 ± 0.003° |
| β | 93.233 ± 0.003° |
| γ | 113.242 ± 0.004° |
| Cell volume | 1797.84 ± 0.12 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 | 0.0612 |
| Residual factor for significantly intense reflections | 0.0505 |
| Weighted residual factors for significantly intense reflections | 0.1342 |
| Weighted residual factors for all reflections included in the refinement | 0.1434 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.055 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179881 (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 7/01/77. |
7017716.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7017716.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7017716.cif |
| 33397 | 2012-02-12 | ../uploads/cif-deposit/cod/cif Adding structures of 7017709, 7017710, 7017711, 7017712, 7017713, 7017714, 7017715, 7017716, 7017717, 7017718 via cif-deposit CGI script. |
7017716.cif |
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