Crystallography Open Database

Information card for entry 7706900

Preview

Coordinates	7706900.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C117 H172 Cl4 N72 Ni8 O28.5
Calculated formula	C108 H132 Cl4 N72 Ni8 O16.5
Title of publication	Preparation of a magnetic metal-organic square and metal-organic cubes using 4,5-bis(2-imidazolinyl)imidazolate: slow magnetization relaxation behavior in mixed-valent octamanganese(ii/iii) clusters.
Authors of publication	Kamebuchi, Hajime; Murakami, Hiroki; Shiga, Ryosuke; Tadokoro, Makoto
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2021
Journal volume	50
Journal issue	16
Pages of publication	5452 - 5464
a	14.6815 ± 0.0006 Å
b	17.6981 ± 0.0008 Å
c	17.8221 ± 0.0008 Å
α	111.082 ± 0.001°
β	98.566 ± 0.001°
γ	106.133 ± 0.001°
Cell volume	3987.4 ± 0.3 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 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	0.1263
Residual factor for significantly intense reflections	0.0765
Weighted residual factors for significantly intense reflections	0.1995
Weighted residual factors for all reflections included in the refinement	0.2393
Goodness-of-fit parameter for all reflections included in the refinement	1.039
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
266022 (current)	2021-06-05	cif/ Updating files of 7706898, 7706899, 7706900 Original log message: Adding full bibliography for 7706898--7706900.cif.	7706900.cif
263194	2021-03-20	cif/ Adding structures of 7706898, 7706899, 7706900 via cif-deposit CGI script.	7706900.cif