Crystallography Open Database

Information card for entry 7230280

Preview

Coordinates	7230280.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H64 Co2 Mo3 N12 O29
Calculated formula	C18 H50 Co2 Mo3 N12 O29
Title of publication	Supramolecular assembly of oxalatomolybdates controlled by the hydrogen bonding potential of Co(iii)-ammine cations
Authors of publication	Cindrić, Marina; Stilinović, Vladimir; Rubčić, Mirta; Medak, Glorija; Šišak Jung, Dubravka; Vrdoljak, Višnja
Journal of publication	CrystEngComm
Year of publication	2018
Journal volume	20
Journal issue	13
Pages of publication	1889
a	13.5465 ± 0.0003 Å
b	11.691 ± 0.0003 Å
c	28.9847 ± 0.0007 Å
α	90°
β	90°
γ	90°
Cell volume	4590.37 ± 0.19 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	295 ± 2 K
Number of distinct elements	6
Space group number	33
Hermann-Mauguin space group symbol	P n a 21
Hall space group symbol	P 2c -2n
Residual factor for all reflections	0.0425
Residual factor for significantly intense reflections	0.0311
Weighted residual factors for significantly intense reflections	0.067
Weighted residual factors for all reflections included in the refinement	0.0688
Goodness-of-fit parameter for all reflections included in the refinement	0.913
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
229060 (current)	2019-11-17	cif/ Updating files of 7230277, 7230278, 7230279, 7230280, 7230281, 7230282, 7230283, 7230284 Original log message: Adding full bibliography for 7230277--7230284.cif.	7230280.cif
206877	2018-03-10	cif/ Adding structures of 7230277, 7230278, 7230279, 7230280, 7230281, 7230282, 7230283, 7230284 via cif-deposit CGI script.	7230280.cif