Crystallography Open Database

Information card for entry 7718742

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Coordinates	7718742.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H48 Br3.95 Cd5 Cl14.05 N8
Calculated formula	C28 H48 Br3.99 Cd5 Cl14.01 N8
Title of publication	Dimensionality-driven photoluminescence enhancement in Cl/Br mixed-halide organic-inorganic hybrid cadmium halides.
Authors of publication	Kim, Boyoung; Ok, Kang Min
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2025
Journal volume	54
Journal issue	23
Pages of publication	9261 - 9269
a	7.5987 ± 0.0002 Å
b	11.7771 ± 0.0003 Å
c	15.6318 ± 0.0003 Å
α	93.707 ± 0.001°
β	90.91 ± 0.001°
γ	101.383 ± 0.001°
Cell volume	1367.93 ± 0.06 Å³
Cell temperature	273 ± 2 K
Ambient diffraction temperature	273 ± 2 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	0.0813
Residual factor for significantly intense reflections	0.0502
Weighted residual factors for significantly intense reflections	0.139
Weighted residual factors for all reflections included in the refinement	0.1662
Goodness-of-fit parameter for all reflections included in the refinement	1.037
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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