Crystallography Open Database

Information card for entry 7242905

Preview

Coordinates	7242905.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C52 H40 Cd2 N4 O12
Calculated formula	C52 H40 Cd2 N4 O12
Title of publication	Zn(ii) and Cd(ii) coordination polymers with a new angular bis-pyridyl-bis-amide: synthesis, structures and sensing properties
Authors of publication	Yang, Xiang-Kai; Lee, Wei-Te; Hu, Ji-Hong; Chen, Jhy-Der
Journal of publication	CrystEngComm
Year of publication	2021
Journal volume	23
Journal issue	25
Pages of publication	4486 - 4493
a	14.2507 ± 0.0004 Å
b	19.6734 ± 0.0007 Å
c	16.6986 ± 0.0005 Å
α	90°
β	98.1584 ± 0.0018°
γ	90°
Cell volume	4634.2 ± 0.3 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
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	0.0565
Residual factor for significantly intense reflections	0.0396
Weighted residual factors for significantly intense reflections	0.0985
Weighted residual factors for all reflections included in the refinement	0.1067
Goodness-of-fit parameter for all reflections included in the refinement	1.037
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
267122 (current)	2021-07-05	cif/ Updating files of 7242904, 7242905 Original log message: Adding full bibliography for 7242904--7242905.cif.	7242905.cif
265474	2021-05-25	cif/ Adding structures of 7242904, 7242905 via cif-deposit CGI script.	7242905.cif