Crystallography Open Database

Information card for entry 4507972

Preview

Coordinates	4507972.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C21 H19 Cu N2 O6
Calculated formula	C21 H19 Cu N2 O6
Title of publication	Structural Diversities and Fluorescent and Photocatalytic Properties of a Series of CuIICoordination Polymers Constructed from Flexible Bis-pyridyl-bis-amide Ligands with Different Spacer Lengths and Different Aromatic Carboxylates
Authors of publication	Wang, Xiu-Li; Luan, Jian; Sui, Fang-Fang; Lin, Hong-Yan; Liu, Guo-Cheng; Xu, Chuang
Journal of publication	Crystal Growth & Design
Year of publication	2013
Journal volume	13
Journal issue	8
Pages of publication	3561
a	11.132 ± 0.0005 Å
b	14.3355 ± 0.0007 Å
c	11.5297 ± 0.0006 Å
α	90°
β	91.768 ± 0.001°
γ	90°
Cell volume	1839.07 ± 0.16 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/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0289
Residual factor for significantly intense reflections	0.0256
Weighted residual factors for significantly intense reflections	0.0701
Weighted residual factors for all reflections included in the refinement	0.0714
Goodness-of-fit parameter for all reflections included in the refinement	1.052
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
179615 (current)	2016-03-24	cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/79.	4507972.cif
87773	2013-08-27	cif/ Adding structures of 4507960, 4507961, 4507962, 4507963, 4507964, 4507965, 4507966, 4507967, 4507968, 4507969, 4507970, 4507971, 4507972 via cif-deposit CGI script.	4507972.cif