Crystallography Open Database

Information card for entry 7249526

Preview

Coordinates	7249526.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H44 Cd4 I6 N14 O2 S2
Calculated formula	C48 H44 Cd4 I6 N14 O2 S2
Title of publication	Synthesis, crystal structures and luminescence properties of Zn(ii) and Cd(ii) coordination compounds assembled from flexible bis(quinolyl) ligands with symmetrical spacers: the influence of coordinated anions
Authors of publication	Zhang, Guoqiang; Pan, Rongkai; Liu, Shenggui; Chen, Huihui
Journal of publication	CrystEngComm
Year of publication	2024
Journal volume	26
Journal issue	46
Pages of publication	6627 - 6639
a	13.4958 ± 0.0005 Å
b	13.0911 ± 0.0006 Å
c	18.1432 ± 0.001 Å
α	90°
β	105.152 ± 0.005°
γ	90°
Cell volume	3094 ± 0.3 Å³
Cell temperature	170 ± 0.1 K
Ambient diffraction temperature	170 ± 0.1 K
Number of distinct elements	7
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	0.0932
Residual factor for significantly intense reflections	0.0553
Weighted residual factors for significantly intense reflections	0.0823
Weighted residual factors for all reflections included in the refinement	0.0938
Goodness-of-fit parameter for all reflections included in the refinement	1.071
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
296471 (current)	2024-12-06	cif/ Updating files of 7249521, 7249522, 7249523, 7249524, 7249525, 7249526, 7249527 Original log message: Adding full bibliography for 7249521--7249527.cif.	7249526.cif
295736	2024-11-04	cif/ Adding structures of 7249521, 7249522, 7249523, 7249524, 7249525, 7249526, 7249527 via cif-deposit CGI script.	7249526.cif