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Information card for entry 7008810
Preview
| Coordinates | 7008810.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C33 H39 Cu F6 N3 P |
|---|---|
| Calculated formula | C33 H39 Cu F6 N3 P |
| SMILES | [Cu]1[n]2c(CCc3c(c(c(c(c3CC)CCc3[n]1cccc3)CC)CCc1ncccc1)CC)cccc2.[P](F)(F)(F)(F)(F)[F-] |
| Title of publication | Structure and photoluminescence property of two-dimensional coordination polymer complexes involving Cu(I)(6)X(6)(X = Cl, Br, I) hexagon prism cluster supported by a tripodal tripyridine ligand with 1,3,5-triethylbenzene spacer. |
| Authors of publication | Ohi, Hiromi; Tachi, Yoshimitsu; Kunimoto, Takashi; Itoh, Shinobu |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2005 |
| Journal issue | 19 |
| Pages of publication | 3146 - 3147 |
| a | 10.027 ± 0.004 Å |
| b | 10.254 ± 0.003 Å |
| c | 16.081 ± 0.006 Å |
| α | 82.509 ± 0.014° |
| β | 77.487 ± 0.019° |
| γ | 82.478 ± 0.017° |
| Cell volume | 1591.3 ± 1 Å3 |
| Cell temperature | 160.1 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for significantly intense reflections | 0.04 |
| Weighted residual factors for all reflections included in the refinement | 0.0593 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.002 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301846 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 7/00/ Each referenced PubChem compound corresponds to the full crystal structure. |
7008810.cif |
| 176453 | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7. |
7008810.cif |
| 120443 | 2014-07-15 | Adding 17924 DOIs guessed from source file names. | 7008810.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7008810.cif |
| 1504 | 2010-09-08 | cif/7/ Adding data extracted from RSC 2005 and 2006 year publications. |
7008810.cif |
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Users of the data should acknowledge the original authors of the
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