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Information card for entry 4300046
Preview
| Coordinates | 4300046.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C10 H8 Fe N12 S2 |
|---|---|
| Calculated formula | C10 H8 Fe N12 S2 |
| Title of publication | New Iron(II) Spin Crossover Coordination Polymers [Fe(μ-atrz)3]X2·2H2O (X = ClO4¯, BF4¯) and [Fe(μ-atrz)(μ-pyz)(NCS)2]·4H2O with an Interesting Solvent Effect |
| Authors of publication | Chuang, Yu-Chun; Liu, Chi-Tsun; Sheu, Chou-Fu; Ho, Wei-Lun; Lee, Gene-Hsiang; Wang, Chih-Cheh; Wang, Yu |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2012 |
| Journal volume | 51 |
| Journal issue | 8 |
| Pages of publication | 4663 - 4671 |
| a | 12.6181 ± 0.0004 Å |
| b | 7.17262 ± 0.00017 Å |
| c | 12.0508 ± 0.0004 Å |
| α | 90° |
| β | 116.396 ± 0.0026° |
| γ | 90° |
| Cell volume | 976.95 ± 0.06 Å3 |
| Cell temperature | 423 K |
| Ambient diffraction temperature | 423 K |
| Number of distinct elements | 5 |
| Space group number | 12 |
| Hermann-Mauguin space group symbol | C 1 2/m 1 |
| Hall space group symbol | -C 2y |
| RFsqd | 0.10456 |
| Goodness-of-fit parameter for all reflections | 2.39 |
| Method of determination | powder diffraction |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 1351 (current) | 2025-07-01 | cif/ Adding structures of 4300039, 4300040, 4300041, 4300042, 4300043, 4300044, 4300045, 4300046 via cif-deposit CGI script. |
4300046.cif |
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Users of the data should acknowledge the original authors of the
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