Crystallography Open Database

Information card for entry 7249527

Preview

Coordinates	7249527.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C51 H55 Cl4 N15 O5 S2 Zn3
Calculated formula	C51 H55 Cl4 N15 O5 S2 Zn3
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	13.6636 ± 0.0005 Å
b	23.7116 ± 0.0011 Å
c	18.948 ± 0.0009 Å
α	90°
β	100.645 ± 0.0014°
γ	90°
Cell volume	6033.2 ± 0.5 Å³
Cell temperature	302 ± 0.1 K
Ambient diffraction temperature	302 ± 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	0.1024
Residual factor for significantly intense reflections	0.0506
Weighted residual factors for significantly intense reflections	0.097
Weighted residual factors for all reflections included in the refinement	0.1235
Goodness-of-fit parameter for all reflections included in the refinement	1.024
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
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.	7249527.cif
295736	2024-11-04	cif/ Adding structures of 7249521, 7249522, 7249523, 7249524, 7249525, 7249526, 7249527 via cif-deposit CGI script.	7249527.cif