Crystallography Open Database

Information card for entry 7059273

Preview

Coordinates	7059273.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H28 Cl Co N10 O6
Calculated formula	C20 H28 Cl Co N10 O6
Title of publication	Theoretical and experimental study of the coordination ability of 4,6-dimethylpyrimidinylhydrazone diacetylmonooxime towards Ni(ii), Mn(ii), Fe(iii) and Co(iii) ions
Authors of publication	Lukov, Vladimir V.; Tsaturyan, Arshak A.; Tupolova, Yulia P.; Popov, Leonid D.; Shcherbakov, Igor N.; Lebedev, Vladimir E.; Askalepova, Olga I.; Lastovina, Tatiana A.; Lazarenko, Vladimir A.; Khustalev, Victor N.; Poler, Jordan C.
Journal of publication	New Journal of Chemistry
Year of publication	2020
Journal volume	44
Journal issue	5
Pages of publication	2146 - 2154
a	8.1014 ± 0.0016 Å
b	22.215 ± 0.004 Å
c	28.766 ± 0.006 Å
α	90°
β	90°
γ	90°
Cell volume	5177.1 ± 1.8 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0662
Residual factor for significantly intense reflections	0.0578
Weighted residual factors for significantly intense reflections	0.1299
Weighted residual factors for all reflections included in the refinement	0.1346
Goodness-of-fit parameter for all reflections included in the refinement	1.142
Diffraction radiation wavelength	0.8042 Å
Diffraction radiation type	synchrotron
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
257711 (current)	2020-10-06	cif/ Updating files of 7059271, 7059272, 7059273, 7059274 Original log message: Adding full bibliography for 7059271--7059274.cif.	7059273.cif
247556	2020-02-04	cif/ Adding structures of 7059271, 7059272, 7059273, 7059274 via cif-deposit CGI script.	7059273.cif