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Information card for entry 4003868
Preview
| Coordinates | 4003868.cif | 
|---|---|
| Original paper (by DOI) | HTML | 
| Formula | C4 H20 Br8 N8 Pb2 | 
|---|---|
| Calculated formula | C4 H20 Br8 N8 Pb2 | 
| Title of publication | FA2PbBr4: Synthesis, Structure, and Unusual Optical Properties of Two Polymorphs of Formamidinium-Based Layered (110) Hybrid Perovskite | 
| Authors of publication | Fateev, Sergey A.; Petrov, Andrey A.; Marchenko, Ekaterina I.; Zubavichus, Yan V.; Khrustalev, Victor N.; Petrov, Andrey V.; Aksenov, Sergey M.; Goodilin, Eugene A.; Tarasov, Alexey B. | 
| Journal of publication | Chemistry of Materials | 
| Year of publication | 2021 | 
| a | 8.5642 ± 0.0017 Å | 
| b | 11.884 ± 0.002 Å | 
| c | 14.312 ± 0.003 Å | 
| α | 65.92 ± 0.03° | 
| β | 73.01 ± 0.03° | 
| γ | 83.76 ± 0.03° | 
| Cell volume | 1271.7 ± 0.6 Å3 | 
| Cell temperature | 100 ± 2 K | 
| Ambient diffraction temperature | 100 ± 2 K | 
| Number of distinct elements | 5 | 
| Space group number | 2 | 
| Hermann-Mauguin space group symbol | P -1 | 
| Hall space group symbol | -P 1 | 
| Residual factor for all reflections | 0.1188 | 
| Residual factor for significantly intense reflections | 0.1115 | 
| Weighted residual factors for significantly intense reflections | 0.2395 | 
| Weighted residual factors for all reflections included in the refinement | 0.2434 | 
| Goodness-of-fit parameter for all reflections included in the refinement | 1.065 | 
| Diffraction radiation wavelength | 0.80246 Å | 
| Diffraction radiation type | synchrotron | 
| Has coordinates | Yes | 
| Has disorder | No | 
| Has Fobs | No | 
| Revision | Date | Message | Files | 
|---|---|---|---|
| 262135 (current) | 2021-02-23 | cif/ Adding structures of 4003868 via cif-deposit CGI script. | 4003868.cif | 
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          Users of the data should acknowledge the original authors of the
          structural data.