Crystallography Open Database

Information card for entry 7231914

7231913 << 7231914 >> 7231915

Preview

Coordinates	7231914.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H36 Br4 Cu4 N8 O4
Calculated formula	C24 H36 Br4 Cu4 N8 O4
Title of publication	Design, synthesis and characterization of copper-based coordination compounds with bidentate (N,N and N,O) ligands: reversible uptake of iodine, dye adsorption and assessment of their antibacterial properties
Authors of publication	Beheshti, Azizolla; Mousavi Fard, Elham Sadat; Kubicki, Maciej; Mayer, Peter; Abrahams, Carmel T.; Razatofighi, Seyedeh Elham
Journal of publication	CrystEngComm
Year of publication	2019
Journal volume	21
Journal issue	2
Pages of publication	251
a	8.9045 ± 0.0004 Å
b	14.2825 ± 0.0004 Å
c	12.8264 ± 0.0007 Å
α	90°
β	95.806 ± 0.005°
γ	90°
Cell volume	1622.87 ± 0.12 Å³
Cell temperature	100 ± 1 K
Ambient diffraction temperature	100 ± 1 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0463
Residual factor for significantly intense reflections	0.0349
Weighted residual factors for significantly intense reflections	0.0867
Weighted residual factors for all reflections included in the refinement	0.0911
Goodness-of-fit parameter for all reflections included in the refinement	1.016
Diffraction radiation probe	x-ray
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
223591 (current)	2019-11-07	cif/ Updating files of 7231912, 7231913, 7231914 Original log message: Adding full bibliography for 7231912--7231914.cif.	7231914.cif
212300	2018-12-04	cif/ Adding structures of 7231912, 7231913, 7231914 via cif-deposit CGI script.	7231914.cif