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Information card for entry 4320367
Preview
| Coordinates | 4320367.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Common name | [NacNacGe][OH{B(C6F5)3}2] |
|---|---|
| Formula | C65 H42 B2 F30 Ge N2 O |
| Calculated formula | C65 H42 B2 F30 Ge N2 O |
| SMILES | [Ge]1N(C(=CC(=[N]1c1c(cccc1C(C)C)C(C)C)C)C)c1c(cccc1C(C)C)C(C)C.[OH]([B](c1c(F)c(F)c(F)c(F)c1F)(c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F)[B](c1c(F)c(F)c(F)c(F)c1F)(c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F |
| Title of publication | Characterization and Bonding of the Cation [Ge{N(C6H3-2,6-i-Pr2)CMe}2CH]+: Comparison with the Isoelectronic Ga{N(C6H3-2,6-i-Pr2)CMe}2CH |
| Authors of publication | Matthias Stender; Andrew D. Phillips; Philip P. Power |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2001 |
| Journal volume | 40 |
| Pages of publication | 5314 - 5315 |
| a | 20.2586 ± 0.0007 Å |
| b | 17.5332 ± 0.0006 Å |
| c | 18.5394 ± 0.0006 Å |
| α | 90° |
| β | 109.736 ± 0.001° |
| γ | 90° |
| Cell volume | 6198.3 ± 0.4 Å3 |
| Cell temperature | 90 ± 2 K |
| Ambient diffraction temperature | 90 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.147 |
| Residual factor for significantly intense reflections | 0.0561 |
| Weighted residual factors for significantly intense reflections | 0.1021 |
| Weighted residual factors for all reflections included in the refinement | 0.1341 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.992 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301838 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 4/32/ Each referenced PubChem compound corresponds to the full crystal structure. |
4320367.cif |
| 179306 | 2016-03-23 | cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/03. |
4320367.cif |
| 120105 | 2014-07-12 | Adding DOIs to range 4/32 structures. | 4320367.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4320367.cif |
| 17271 | 2011-04-06 | ../uploads/cif-deposit/cod/cif Adding structures of 4320367 via cif-deposit CGI script. |
4320367.cif |
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Users of the data should acknowledge the original authors of the
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