Crystallography Open Database

Information card for entry 7055033

Preview

Coordinates	7055033.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	compound-5
Formula	C13 H14 Ag N3 O3 Se2
Calculated formula	C13 H14 Ag N3 O3 Se2
Title of publication	Metal complexes with bis(2-pyridyl)diselenoethers: structural chemistry and catalysis
Authors of publication	Cargnelutti, Roberta; da Silva, Felipe Dornelles; Abram, Ulrich; Lang, Ernesto Schulz
Journal of publication	New J. Chem.
Year of publication	2015
Journal volume	39
Journal issue	10
Pages of publication	7948
a	9.791 ± 0.001 Å
b	4.442 ± 0.001 Å
c	20.883 ± 0.003 Å
α	90°
β	90.96 ± 0.01°
γ	90°
Cell volume	908.1 ± 0.3 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	6
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	0.0878
Residual factor for significantly intense reflections	0.0572
Weighted residual factors for significantly intense reflections	0.1522
Weighted residual factors for all reflections included in the refinement	0.166
Goodness-of-fit parameter for all reflections included in the refinement	0.947
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
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.	7055033.cif
162074	2015-10-09	cif/ Updating files of 7055029, 7055030, 7055031, 7055032, 7055033, 7055034 Original log message: Adding full bibliography for 7055029--7055034.cif.	7055033.cif
152609	2015-07-29	cif/ Adding structures of 7055029, 7055030, 7055031, 7055032, 7055033, 7055034 via cif-deposit CGI script.	7055033.cif