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Information card for entry 4003048
Preview
| Coordinates | 4003048.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C4 H13 I3 N2 O Pb |
|---|---|
| Calculated formula | C4 H13 I3 N2 O Pb |
| Title of publication | Controlling Solvate Intermediate Growth for Phase-Pure Organic Lead Iodide Ruddlesden‒Popper (C4H9NH3)2(CH3NH3)n−1PbnI3n+1 Perovskite Thin Films |
| Authors of publication | Dahlman, Clayton J.; DeCrescent, Ryan A.; Venkatesan, Naveen R.; Kennard, Rhys M.; Wu, Guang; Everest, Michael A.; Schuller, Jon A.; Chabinyc, Michael L. |
| Journal of publication | Chemistry of Materials |
| Year of publication | 2019 |
| Journal volume | 31 |
| Journal issue | 15 |
| Pages of publication | 5832 |
| a | 4.5723 ± 0.0002 Å |
| b | 25.3424 ± 0.0011 Å |
| c | 12.1782 ± 0.0005 Å |
| α | 90° |
| β | 96.075 ± 0.003° |
| γ | 90° |
| Cell volume | 1403.2 ± 0.1 Å3 |
| Cell temperature | 260 ± 2 K |
| Ambient diffraction temperature | 260 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.1267 |
| Residual factor for significantly intense reflections | 0.074 |
| Weighted residual factors for significantly intense reflections | 0.1674 |
| Weighted residual factors for all reflections included in the refinement | 0.1898 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.043 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 220467 (current) | 2019-10-29 | cif/ Adding structures of 4003048 via cif-deposit CGI script. |
4003048.cif |
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Users of the data should acknowledge the original authors of the
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