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Information card for entry 7048700
Preview
| Coordinates | 7048700.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C50 H72 Ca N6 |
|---|---|
| Calculated formula | C50 H72 Ca N6 |
| Title of publication | Synthesis and catalytic activity of tridentate N-(2-pyridylethyl)-substituted bulky amidinates of calcium and strontium. |
| Authors of publication | Krieck, Sven; Kalden, Diana; Oberheide, Ansgar; Seyfarth, Lydia; Arndt, Hans-Dieter; Görls, Helmar; Westerhausen, Matthias |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2019 |
| Journal volume | 48 |
| Journal issue | 7 |
| Pages of publication | 2479 - 2490 |
| a | 11.9581 ± 0.0002 Å |
| b | 16.9041 ± 0.0003 Å |
| c | 12.7267 ± 0.0002 Å |
| α | 90° |
| β | 114.685 ± 0.001° |
| γ | 90° |
| Cell volume | 2337.5 ± 0.07 Å3 |
| Cell temperature | 133 ± 2 K |
| Ambient diffraction temperature | 133 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.0412 |
| Residual factor for significantly intense reflections | 0.0374 |
| Weighted residual factors for significantly intense reflections | 0.0816 |
| Weighted residual factors for all reflections included in the refinement | 0.0841 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.042 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301850 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 7/04/ Each referenced PubChem compound corresponds to the full crystal structure. |
7048700.cif |
| 224301 | 2019-11-08 | cif/ Updating files of 7048697, 7048698, 7048699, 7048700, 7048701, 7048702 Original log message: Adding full bibliography for 7048697--7048702.cif. |
7048700.cif |
| 213270 | 2019-01-24 | cif/ Adding structures of 7048697, 7048698, 7048699, 7048700, 7048701, 7048702 via cif-deposit CGI script. |
7048700.cif |
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Users of the data should acknowledge the original authors of the
structural data.