Crystallography Open Database

Information card for entry 8107149

Preview

Coordinates	8107149.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H19 Cd N5 O4
Calculated formula	C22 H19 Cd N5 O4
Title of publication	Crystal structure poly-(μ2-1-(4-(1H-imidazol-1-yl)benzyl)-1H-1,2,4-triazolyl-κ2 N N 1:N 2 N)-(μ3-2,2′-(1,2-phenylene)diacetato-κ5-O 1,O 2:O 2:O 3,O 4)cadmium(II), C22H19CdN5O4
Authors of publication	Xin, Ling-Yun; Li, Xiao-Ling; Liu, Guang-Zhen
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2016
Journal volume	231
Journal issue	4
Pages of publication	1215 - 1217
a	11.7546 ± 0.0016 Å
b	19.769 ± 0.003 Å
c	9.5012 ± 0.0013 Å
α	90°
β	106.252 ± 0.002°
γ	90°
Cell volume	2119.6 ± 0.5 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/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0487
Residual factor for significantly intense reflections	0.0348
Weighted residual factors for significantly intense reflections	0.0814
Weighted residual factors for all reflections included in the refinement	0.0884
Goodness-of-fit parameter for all reflections included in the refinement	1.01
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
283622 (current)	2023-05-09	cif/ Adding structures of 8107149 via cif-deposit CGI script.	8107149.cif