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Information card for entry 7031224
Preview
Coordinates | 7031224.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C40 H28 Cu2 F8 N6 O8 |
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Calculated formula | C36 H22 Cu2 F8 N4 O8 |
Title of publication | Crystal structures, CO2 adsorption, and dielectric properties of [Cu(ii)2(R-benzoate)4(pyrazine)]∞polymers (R = m-F, 2,3-F2, m-Cl, and m-CH3). |
Authors of publication | Takahashi, Kiyonori; Hoshino, Norihisa; Takeda, Takashi; Noro, Shin-Ichiro; Nakamura, Takayoshi; Takeda, Sadamu; Akutagawa, Tomoyuki |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2014 |
Journal volume | 43 |
Journal issue | 24 |
Pages of publication | 9081 - 9089 |
a | 20.2293 ± 0.0004 Å |
b | 20.5119 ± 0.0004 Å |
c | 19.3078 ± 0.0003 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 8011.6 ± 0.3 Å3 |
Cell temperature | 108 ± 2 K |
Ambient diffraction temperature | 108 ± 2 K |
Number of distinct elements | 6 |
Space group number | 56 |
Hermann-Mauguin space group symbol | P c c n |
Hall space group symbol | -P 2ab 2ac |
Residual factor for all reflections | 0.1642 |
Residual factor for significantly intense reflections | 0.1104 |
Weighted residual factors for significantly intense reflections | 0.3127 |
Weighted residual factors for all reflections included in the refinement | 0.3547 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.107 |
Diffraction radiation wavelength | 1.54187 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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