Crystallography Open Database

Information card for entry 1574064

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Coordinates	1574064.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H18 Cd2 Cl5 N O2
Calculated formula	C12 H18 Cd2 Cl5 N O2
Title of publication	Efficient energy transfer from organic triplet states to Mn<sup>2+</sup> dopants for dynamic tunable multicolor afterglow in 1D hybrid cadmium chloride.
Authors of publication	Zhang, Ke; Qi, Zhikai; Zhang, Nan; Zhao, Xingxing; Fan, Yanli; Sun, Long; Zhou, Guojun; Li, Shi-Li; Zhang, Xian-Ming
Journal of publication	Chemical science
Year of publication	2025
Journal volume	16
Journal issue	14
Pages of publication	6104 - 6113
a	7.5573 ± 0.0008 Å
b	15.3477 ± 0.0016 Å
c	16.6274 ± 0.0018 Å
α	90°
β	94.566 ± 0.002°
γ	90°
Cell volume	1922.4 ± 0.4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.0597
Residual factor for significantly intense reflections	0.0474
Weighted residual factors for significantly intense reflections	0.1323
Weighted residual factors for all reflections included in the refinement	0.1386
Goodness-of-fit parameter for all reflections included in the refinement	1.191
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
298789 (current)	2025-04-05	cif/ Updating files of 1574064 Original log message: Adding full bibliography for 1574064.cif.	1574064.cif
298308	2025-03-07	cif/ Adding structures of 1574064 via cif-deposit CGI script.	1574064.cif