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Information card for entry 7032867
Preview
Coordinates | 7032867.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C46 H46 Cl2 Cu F6 N2 O2 P3 |
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Calculated formula | C46 H46 Cl2 Cu F6 N2 O2 P3 |
SMILES | [Cu]12([P](c3ccccc3)(C[C@@H]3OC(O[C@H]3C[P]1(c1ccccc1)c1ccccc1)(C)C)c1ccccc1)[n]1c3c4[n]2c(C)ccc4ccc3ccc1C.[P](F)(F)(F)(F)(F)[F-].ClCCl |
Title of publication | Highly emissive copper(I) complexes bearing diimine and bis(diphenylphosphinomethyl)-2,2-dimethyl-1,3-dioxolane. |
Authors of publication | Nishikawa, Michihiro; Sawamura, Shota; Haraguchi, Aya; Morikubo, Jun; Takao, Koichiro; Tsubomura, Taro |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2015 |
Journal volume | 44 |
Journal issue | 1 |
Pages of publication | 411 - 418 |
a | 9.927 ± 0.009 Å |
b | 11.073 ± 0.01 Å |
c | 11.197 ± 0.011 Å |
α | 90.23 ± 0.03° |
β | 90.84 ± 0.03° |
γ | 112.89 ± 0.03° |
Cell volume | 1133.7 ± 1.8 Å3 |
Cell temperature | 123 ± 2 K |
Ambient diffraction temperature | 123 ± 2 K |
Number of distinct elements | 8 |
Space group number | 1 |
Hermann-Mauguin space group symbol | P 1 |
Hall space group symbol | P 1 |
Residual factor for all reflections | 0.0823 |
Residual factor for significantly intense reflections | 0.0558 |
Weighted residual factors for all reflections included in the refinement | 0.138 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.032 |
Diffraction radiation wavelength | 0.7107 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
180034 (current) | 2016-03-25 | cif/7/03/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/03/28. |
7032867.cif |
131074 | 2015-02-04 | cif/ Updating files of 7032867, 7032868 Original log message: Adding full bibliography for 7032867--7032868.cif. |
7032867.cif |
125654 | 2014-10-22 | cif/ Adding structures of 7032867, 7032868 via cif-deposit CGI script. |
7032867.cif |
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