Crystallography Open Database

Information card for entry 7708550

Preview

Coordinates	7708550.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C33 H30.8 Co3 N16 O4.4 S
Calculated formula	C33 H30.8 Co3 N16 O4.4 S
Title of publication	Field-induced Single Ion Magnet behaviour in discrete and one-dimensional complexes containing the bis(1-methylimidazol-2-yl)ketone]-containing cobalt(II) building units
Authors of publication	Jiménez, Juan-Ramón; Xu, Buqin; El Said, Hasnaa; Li, Yanling; von Bardeleben, Jurgen; Chamoreau, Lise-Marie; Lescouezec, Rodrigue; Shova, Sergiu; Visinescu, Diana; Alexandru, Maria-Gabriela; Cano, Joan; Julve, Miguel
Journal of publication	Dalton Transactions
Year of publication	2021
a	12.231 ± 0.003 Å
b	8.1876 ± 0.0011 Å
c	21.11 ± 0.004 Å
α	90°
β	96.09 ± 0.02°
γ	90°
Cell volume	2102.1 ± 0.7 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	7
Hermann-Mauguin space group symbol	P 1 c 1
Hall space group symbol	P -2yc
Residual factor for all reflections	0.1665
Residual factor for significantly intense reflections	0.0869
Weighted residual factors for significantly intense reflections	0.1326
Weighted residual factors for all reflections included in the refinement	0.1638
Goodness-of-fit parameter for all reflections included in the refinement	1.012
Diffraction radiation probe	x-ray
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
269926 (current)	2021-10-14	cif/ Adding structures of 7708550, 7708551, 7708552, 7708553 via cif-deposit CGI script.	7708550.cif