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Information card for entry 7206713
Preview
Coordinates | 7206713.cif |
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Original paper (by DOI) | HTML |
Formula | C84 H98.5 Cl7 Cu N4 O10.5 |
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Calculated formula | C84 H98.5 Cl7 Cu N4 O10.5 |
Title of publication | Co-crystal of [CuCl4]2− and L1 and its inclusion compounds with three different guests (L1 = N,N,N′,N′-tetra-p-methoxybenzyl-ethylenediamine) |
Authors of publication | Guo, Fang; Zhang, Ming-qian; Lu, Na; Guan, Hong-yu; Tong, Jian; Wang, Bao-xin |
Journal of publication | CrystEngComm |
Year of publication | 2011 |
Journal volume | 13 |
Journal issue | 22 |
Pages of publication | 6753 |
a | 15.823 ± 0.003 Å |
b | 17.165 ± 0.003 Å |
c | 18.838 ± 0.004 Å |
α | 64.88 ± 0.03° |
β | 72.07 ± 0.03° |
γ | 63.17 ± 0.03° |
Cell volume | 4090.8 ± 1.9 Å3 |
Cell temperature | 113 ± 2 K |
Ambient diffraction temperature | 113 ± 2 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 all reflections | 0.0716 |
Residual factor for significantly intense reflections | 0.057 |
Weighted residual factors for significantly intense reflections | 0.1557 |
Weighted residual factors for all reflections included in the refinement | 0.1633 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.054 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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