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Information card for entry 4074664
Preview
| Coordinates | 4074664.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C24 H30 B Ge Na |
|---|---|
| Calculated formula | C24 H30 B Ge Na |
| SMILES | [Ge](CC)(CC)(CC)[B](c1ccccc1)(c1ccccc1)c1ccccc1.[Na+] |
| Title of publication | Preparation, Structural Characterization, and Photochemical Reactions of Silyl- and Germylborates |
| Authors of publication | Nanjo, Masato; Matsudo, Kazuhiko; Kurihara, Mari; Nakamura, Sayaka; Sakaguchi, Yoshio; Hayashi, Hisaharu; Mochida, Kunio |
| Journal of publication | Organometallics |
| Year of publication | 2006 |
| Journal volume | 25 |
| Journal issue | 4 |
| Pages of publication | 832 |
| a | 12.497 ± 0.0005 Å |
| b | 11.675 ± 0.0006 Å |
| c | 15.574 ± 0.0006 Å |
| α | 90° |
| β | 102.449 ± 0.003° |
| γ | 90° |
| Cell volume | 2218.86 ± 0.17 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0307 |
| Residual factor for significantly intense reflections | 0.0298 |
| Weighted residual factors for significantly intense reflections | 0.1107 |
| Weighted residual factors for all reflections included in the refinement | 0.1128 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.09 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301830 (current) | 2025-08-20 | Add cross-references to PubChem compounds in COD range 4/07/ Each referenced PubChem compound corresponds to the full crystal structure. |
4074664.cif |
| 178635 | 2016-03-21 | cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/46. |
4074664.cif |
| 120075 | 2014-07-11 | Adding DOIs to range 4/07 structures. | 4074664.cif |
| 107967 | 2014-03-25 | cif/4 Changing the � entity to the proper non-English character for many entries in subdir 4 |
4074664.cif |
| 48639 | 2012-03-27 | ../uploads/cif-deposit/cod/cif Adding structures of 4074664 via cif-deposit CGI script. |
4074664.cif |
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Users of the data should acknowledge the original authors of the
structural data.