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Information card for entry 7714744
Preview
Coordinates | 7714744.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | Tetra-μ3-iodo-tetrakis[(η1-As)-2-methoxy-6-(10H-phenoxarsinin-10-yl)pyridine]-tetracopper (I) |
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Formula | C56 H45 As3 Cu4 I4 N4 O6 |
Calculated formula | C56 H45 As3 Cu4 I4 N4 O6 |
SMILES | [As]1(c2ccccc2Oc2ccccc12)(c1cccc(n1)OC)[Cu]12345[Cu]6789([Cu]%10%111([As]1(c%12ccccc%12Oc%12ccccc1%12)c1cccc(n1)OC)([Cu]26([As]1(c2ccccc2Oc2ccccc12)c1cccc(n1)OC)([I]7%10)([I]3%11)[I]48)[I]59)[N]#CC |
Title of publication | Design of luminescent complexes with different Cu<sub>4</sub>I<sub>4</sub> cores based on pyridyl phenoxarsines. |
Authors of publication | Galimova, Milyausha F.; Zueva, Ekaterina M.; Petrova, Maria M.; Dobrynin, Alexey B.; Kolesnikov, Ilya E.; Musina, Elvira I.; Musin, Rustem R.; Karasik, Andrey A.; Sinyashin, Oleg G. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2024 |
Journal volume | 53 |
Journal issue | 3 |
Pages of publication | 1087 - 1098 |
a | 21.9973 ± 0.0018 Å |
b | 16.6381 ± 0.0012 Å |
c | 17.2785 ± 0.0013 Å |
α | 90° |
β | 109.356 ± 0.003° |
γ | 90° |
Cell volume | 5966.4 ± 0.8 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 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 | 0.0875 |
Residual factor for significantly intense reflections | 0.0793 |
Weighted residual factors for significantly intense reflections | 0.2119 |
Weighted residual factors for all reflections included in the refinement | 0.2153 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.196 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
289559 (current) | 2024-02-04 | cif/ Updating files of 7714737, 7714738, 7714739, 7714740, 7714741, 7714742, 7714743, 7714744 Original log message: Adding full bibliography for 7714737--7714744.cif. |
7714744.cif |
288362 | 2023-12-16 | cif/ Adding structures of 7714737, 7714738, 7714739, 7714740, 7714741, 7714742, 7714743, 7714744 via cif-deposit CGI script. |
7714744.cif |
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