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Information card for entry 1551318
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Coordinates | 1551318.cif |
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Original paper (by DOI) | HTML |
Chemical name | quinuclidinium perrhenate |
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Formula | C7 H14 N O4 Re |
Calculated formula | C7.9992 O4 Re |
Title of publication | Directionally tunable and mechanically deformable ferroelectric crystals from rotating polar globular ionic molecules |
Authors of publication | Jun Harada; Takafumi Shimojo; Hideaki Oyamaguchi; Hiroyuki Hasegawa; Yukihiro Takahashi; Koichiro Satomi; Yasutaka Suzuki; Jun Kawamata; Tamotsu Inabe |
Journal of publication | Nature Chemistry |
Year of publication | 2016 |
Journal volume | 8 |
Pages of publication | 946 - 952 |
a | 6.3881 ± 0.0011 Å |
b | 6.3881 ± 0.0011 Å |
c | 6.3881 ± 0.0011 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 260.68 ± 0.08 Å3 |
Cell temperature | 380 K |
Ambient diffraction temperature | 380 K |
Number of distinct elements | 5 |
Space group number | 221 |
Hermann-Mauguin space group symbol | P m -3 m |
Hall space group symbol | -P 4 2 3 |
Residual factor for all reflections | 0.0381 |
Residual factor for significantly intense reflections | 0.0375 |
Weighted residual factors for significantly intense reflections | 0.0994 |
Weighted residual factors for all reflections included in the refinement | 0.1 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.179 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
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215815 (current) | 2019-06-11 | cif/ Adding structures of 1551318 via cif-deposit CGI script. |
1551318.cif |
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