Crystallography Open Database

Information card for entry 7037090

Preview

Coordinates	7037090.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C17 H18 Cd N2 O6
Calculated formula	C17 H18 Cd N2 O6
Title of publication	Tuning different kinds of entangled metal-organic frameworks by modifying the spacer group of aliphatic dicarboxylate ligands and the reactant ratio.
Authors of publication	Yang, Jin-Xia; Zhai, Ji-Quan; Zhang, Xin; Qin, Ye-Yan; Yao, Yuan-Gen
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2015
Journal volume	45
Journal issue	2
Pages of publication	711 - 723
a	8.197 ± 0.002 Å
b	18.032 ± 0.005 Å
c	12.981 ± 0.004 Å
α	90°
β	104.558 ± 0.005°
γ	90°
Cell volume	1857.1 ± 0.9 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.0424
Residual factor for significantly intense reflections	0.0351
Weighted residual factors for significantly intense reflections	0.0914
Weighted residual factors for all reflections included in the refinement	0.0954
Goodness-of-fit parameter for all reflections included in the refinement	1.087
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
176428 (current)	2016-02-13	Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively.	7037090.cif
176000	2016-02-05	cif/ Updating files of 7037090, 7037091, 7037092, 7037093, 7037094, 7037095 Original log message: Adding full bibliography for 7037090--7037095.cif.	7037090.cif
170112	2015-11-06	cif/ Adding structures of 7037090, 7037091, 7037092, 7037093, 7037094, 7037095 via cif-deposit CGI script.	7037090.cif