Information card for entry 2312151
Formula |
C3 H16 Cl4 Mn N2 O2 |
Calculated formula |
C3 H16 Cl4 Mn N2 O2 |
Title of publication |
Synthesis, crystal structure and phase transitions of novel hybrid perovskite: bis(1,2-diaminopropane) di-μ-chloro-bis[diaquadichloromanganate(II)] dichloride. |
Authors of publication |
Abdel-Aal, Seham K; Souhassou, Mohamed; Durand, Pierrick; Lecomte, Claude; Abdel-Rahman, Ahmed S; Claiser, Nicolas |
Journal of publication |
Acta crystallographica Section B, Structural science, crystal engineering and materials |
Year of publication |
2023 |
Journal volume |
79 |
Journal issue |
4 |
a |
5.9138 ± 0.0002 Å |
b |
9.8318 ± 0.0004 Å |
c |
10.8908 ± 0.0004 Å |
α |
73.154 ± 0.004° |
β |
76.691 ± 0.003° |
γ |
87.551 ± 0.003° |
Cell volume |
589.58 ± 0.04 Å3 |
Cell temperature |
100 ± 5 K |
Ambient diffraction temperature |
100.15 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 |
0.0532 |
Residual factor for significantly intense reflections |
0.0331 |
Weighted residual factors for significantly intense reflections |
0.0637 |
Weighted residual factors for all reflections included in the refinement |
0.0737 |
Goodness-of-fit parameter for all reflections included in the refinement |
0.9956 |
Diffraction radiation wavelength |
0.71073 Å |
Diffraction radiation type |
MoKα |
Has coordinates |
Yes |
Has disorder |
No |
Has Fobs |
Yes |
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https://www.crystallography.net/2312151.html