Crystallography Open Database

Information card for entry 7228325

Preview

Coordinates	7228325.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C49 H65 Cl27 N8 Ni2 O8
Calculated formula	C49 H65 Cl27 N8 Ni2 O8
Title of publication	Structural, spectral and magnetic properties of Ni(II), Co(II) and Cd(II) compounds with imidazole derivatives and silanethiolate ligands
Authors of publication	Kowalkowska, Daria; Dołęga, Anna; Nedelko, Natalia; Hnatejko, Zbigniew; Ponikiewski, Łukasz; Matracka, Alicja; Ślawska-Waniewska, Anna; Strągowska, Alicja; Słowy, Klaudia; Gazda, Maria; Pladzyk, Agnieszka
Journal of publication	CrystEngComm
Year of publication	2017
a	14.0403 ± 0.0007 Å
b	16.2198 ± 0.0008 Å
c	18.3694 ± 0.0009 Å
α	87.591 ± 0.004°
β	78.654 ± 0.004°
γ	88.153 ± 0.004°
Cell volume	4096.7 ± 0.4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1368
Residual factor for significantly intense reflections	0.0867
Weighted residual factors for significantly intense reflections	0.2129
Weighted residual factors for all reflections included in the refinement	0.2788
Goodness-of-fit parameter for all reflections included in the refinement	1.056
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
197011 (current)	2017-05-27	cif/ Adding structures of 7228324, 7228325, 7228326, 7228327, 7228328, 7228329 via cif-deposit CGI script.	7228325.cif