Crystallography Open Database

Information card for entry 4349713

Preview

Coordinates	4349713.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	[Cd(Etmal)(H2O)]n
Formula	C14 H24 Cd2 O10
Calculated formula	C14 H20 Cd2 O10
Title of publication	Cadmium(ii) coordination polymers based on substituted malonic acid: synthesis, characterization and photoluminescence properties
Authors of publication	Déniz, Mariadel; Pasán, Jorge; Rasines, Beatriz; Lorenzo-Luis, Pablo; Lahoz, Fernando; Vera-Gonzales, Corina; Julve, Miguel; Ruiz-Pérez, Catalina
Journal of publication	Inorganic Chemistry Frontiers
Year of publication	2017
Journal volume	4
Journal issue	8
Pages of publication	1384
a	9.253 ± 0.0019 Å
b	7.874 ± 0.0016 Å
c	25.531 ± 0.005 Å
α	90°
β	90°
γ	90°
Cell volume	1860.1 ± 0.6 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	4
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0409
Residual factor for significantly intense reflections	0.0401
Weighted residual factors for significantly intense reflections	0.1091
Weighted residual factors for all reflections included in the refinement	0.11
Goodness-of-fit parameter for all reflections included in the refinement	1.088
Diffraction radiation wavelength	0.738 Å
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
235762 (current)	2019-11-24	cif/ Adding structures of 4349712, 4349713, 4349714, 4349715 via cif-deposit CGI script.	4349713.cif