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Information card for entry 7041986
Preview
Coordinates | 7041986.cif |
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Original paper (by DOI) | HTML |
Formula | C20 H42.88 Cu4.78 N13.56 O24.12 |
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Calculated formula | C20 H42.88 Cu4.78 N13.56 O24.12 |
Title of publication | Spontaneous ligand nitrosation and self-assembly into a pentacopper metallacrown complex. |
Authors of publication | Otsuki, Joe; Sekine, Tatsuki; Kida, Yuki; Shinozaki, Yoshinao; Kobayashi, Sayaka; Tamura, Takahiro; Sugawa, Kosuke; Yoshikawa, Isao; Houjou, Hirohiko; Yoshikawa, Hiroki; Tsukamoto, Arata |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2017 |
Journal volume | 46 |
Journal issue | 9 |
Pages of publication | 2760 - 2764 |
a | 15.965 ± 0.004 Å |
b | 20.231 ± 0.005 Å |
c | 13.227 ± 0.003 Å |
α | 90° |
β | 111.993 ± 0.003° |
γ | 90° |
Cell volume | 3961.3 ± 1.7 Å3 |
Cell temperature | 93 ± 2 K |
Ambient diffraction temperature | 93 ± 2 K |
Number of distinct elements | 5 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0403 |
Residual factor for significantly intense reflections | 0.0344 |
Weighted residual factors for significantly intense reflections | 0.0924 |
Weighted residual factors for all reflections included in the refinement | 0.0953 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.05 |
Diffraction radiation wavelength | 0.71075 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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