Crystallography Open Database

Information card for entry 2023156

2023155 << 2023156 >> 2023157

Preview

Coordinates	2023156.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	Diisoselenocyanatotetrakis(2-methylpyridine <i>N</i>-oxide)cobalt(II)
Formula	C26 H28 Co N6 O4 Se2
Calculated formula	C26 H28 Co N6 O4 Se2
Title of publication	Syntheses and crystal structures of the five- and sixfold coordinated complexes diiso-seleno-cyanato-tris-(2-methyl-pyridine <i>N</i>-oxide)cobalt(II) and diiso-seleno-cyanato-tetra-kis-(2-methyl-pyridine <i>N</i>-oxide)cobalt(II).
Authors of publication	Näther, Christian; Jess, Inke
Journal of publication	Acta crystallographica. Section E, Crystallographic communications
Year of publication	2024
Journal volume	80
Journal issue	Pt 7
Pages of publication	704 - 708
a	9.3825 ± 0.0001 Å
b	39.9164 ± 0.0003 Å
c	15.992 ± 0.0001 Å
α	90°
β	104.217 ± 0.001°
γ	90°
Cell volume	5805.82 ± 0.09 Å³
Cell temperature	100.15 K
Ambient diffraction temperature	100.15 K
Number of distinct elements	6
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	0.0402
Residual factor for significantly intense reflections	0.0379
Weighted residual factors for significantly intense reflections	0.1068
Weighted residual factors for all reflections included in the refinement	0.1085
Goodness-of-fit parameter for all reflections included in the refinement	1.046
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
294011 (current)	2024-08-07	cif/ Updating files of 2023156, 2023157 Original log message: Adding full bibliography for 2023156--2023157.cif.	2023156.cif
292269	2024-06-08	cif/ Adding structures of 2023156, 2023157 via cif-deposit CGI script.	2023156.cif