Crystallography Open Database

Information card for entry 7210200

Preview

Coordinates	7210200.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H14 Cd2 O12
Calculated formula	C16 H12 Cd2 O12
Title of publication	Metal-directed topological diversity of three fluorescent metal‒organic frameworks based on a new tetracarboxylate strut
Authors of publication	Lou, Xin-Hua; Xu, Chen; Li, Hong-Mei; Wang, Zhi-Qiang; Guo, Hui; Xue, Dong-Xu
Journal of publication	CrystEngComm
Year of publication	2013
Journal volume	15
Journal issue	23
Pages of publication	4606
a	12.8567 ± 0.0003 Å
b	8.9378 ± 0.0002 Å
c	16.0555 ± 0.0004 Å
α	90°
β	101.613 ± 0.002°
γ	90°
Cell volume	1807.18 ± 0.07 Å³
Cell temperature	291 ± 2 K
Ambient diffraction temperature	291.15 K
Number of distinct elements	4
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/c 1
Hall space group symbol	-P 2yc
Residual factor for all reflections	0.0381
Residual factor for significantly intense reflections	0.0301
Weighted residual factors for significantly intense reflections	0.0624
Weighted residual factors for all reflections included in the refinement	0.0661
Goodness-of-fit parameter for all reflections included in the refinement	1.069
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
180433 (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 7/21/02.	7210200.cif
87059	2013-07-13	cif/ Adding structures of 7210200, 7210201, 7210202 via cif-deposit CGI script.	7210200.cif