Crystallography Open Database

Information card for entry 7218616

Preview

Coordinates	7218616.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C19 H18 Cd N3 O4 S
Calculated formula	C19 H18 Cd N3 O4 S
Title of publication	Four d10 metal coordination polymers based on bis(2-methyl imidazole) spacers: syntheses, interpenetrating structures and photoluminescence properties
Authors of publication	Xue, Li-Ping; Chang, xinhong; Ma, Lufang; Wang, Liya
Journal of publication	RSC Adv.
Year of publication	2014
a	9.4781 ± 0.001 Å
b	13.8347 ± 0.0014 Å
c	15.4666 ± 0.0016 Å
α	90°
β	90°
γ	90°
Cell volume	2028.1 ± 0.4 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	33
Hermann-Mauguin space group symbol	P n a 21
Hall space group symbol	P 2c -2n
Residual factor for all reflections	0.0276
Residual factor for significantly intense reflections	0.0244
Weighted residual factors for significantly intense reflections	0.0602
Weighted residual factors for all reflections included in the refinement	0.0627
Goodness-of-fit parameter for all reflections included in the refinement	1.026
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
180517 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/86.	7218616.cif
126084	2014-10-31	cif/ Adding structures of 7218614, 7218615, 7218616, 7218617 via cif-deposit CGI script.	7218616.cif