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Information card for entry 4321971
Preview
| Coordinates | 4321971.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C34 H44 B2 Cu2 F8 N6 O2 |
|---|---|
| Calculated formula | C34 H44 B2 Cu2 F8 N6 O2 |
| Title of publication | Monoprotic Tetradentate N3O-Donor Ligands and Their Cu(II) and Ni(II) Complexes |
| Authors of publication | Hongyan Luo; Jem-Mau Lo; Phillip E. Fanwick; Joseph G. Stowell; Mark A. Green |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 1999 |
| Journal volume | 38 |
| Pages of publication | 2071 - 2078 |
| a | 9.1471 ± 0.0004 Å |
| b | 10.3753 ± 0.0003 Å |
| c | 10.5352 ± 0.0005 Å |
| α | 107.2 ± 0.003° |
| β | 91.193 ± 0.002° |
| γ | 105.052 ± 0.003° |
| Cell volume | 917.17 ± 0.07 Å3 |
| Cell temperature | 296 K |
| Ambient diffraction temperature | 296 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for significantly intense reflections | 0.074 |
| Weighted residual factors for all reflections included in the refinement | 0.208 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.04 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MO-Kα |
| 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. |
4321971.cif |
| 179322 | 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 4/32/19. |
4321971.cif |
| 120105 | 2014-07-12 | Adding DOIs to range 4/32 structures. | 4321971.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4321971.cif |
| 19835 | 2011-05-26 | ../uploads/cif-deposit/cod/cif Adding structures of 4321971 via cif-deposit CGI script. |
4321971.cif |
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Users of the data should acknowledge the original authors of the
structural data.