Crystallography Open Database

Information card for entry 7714936

Preview

Coordinates	7714936.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C13 H27 Cl4 Mn2 N O6
Calculated formula	C13 H27 Cl4 Mn2 N O6
Title of publication	Supramolecular crystals of Mn(15-crown-5)(MnCl<sub>4</sub>)(DMF) with dielectric phase transition, high quantum yield and phase transition-induced luminescence enhancement behavior.
Authors of publication	Yuan, Guo-Jun; Pan, Xue-Wei; Chen, Li; Chen, Chao; Ren, Xiao-Ming
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2024
Journal volume	53
Journal issue	6
Pages of publication	2687 - 2695
a	10.292 ± 0.002 Å
b	14.75 ± 0.004 Å
c	15.679 ± 0.004 Å
α	90°
β	90°
γ	90°
Cell volume	2380.2 ± 1 Å³
Cell temperature	360 ± 2 K
Ambient diffraction temperature	360 K
Number of distinct elements	6
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.1072
Residual factor for significantly intense reflections	0.062
Weighted residual factors for significantly intense reflections	0.1475
Weighted residual factors for all reflections included in the refinement	0.1832
Goodness-of-fit parameter for all reflections included in the refinement	1.047
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
290183 (current)	2024-03-04	cif/ Updating files of 7714934, 7714935, 7714936 Original log message: Adding full bibliography for 7714934--7714936.cif.	7714936.cif
288709	2024-01-06	cif/ Adding structures of 7714934, 7714935, 7714936 via cif-deposit CGI script.	7714936.cif