Crystallography Open Database

Information card for entry 7208167

7208166 << 7208167 >> 7208168

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Coordinates	7208167.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C51 H25 Co2 F18 O12
Calculated formula	C51 H25 Co2 F18 O12
Title of publication	Tuning the magnetic properties of transition metal MOFs by metal‒oxygen condensation control: the relation between synthesis temperature, SBU nuclearity and carboxylate geometry
Authors of publication	Bernini, Maria C.; Platero-Prats, Ana E.; Snejko, Natalia; Gutiérrez-Puebla, Enrique; Labrador, Ana; Sáez-Puche, Regino; Romero de Paz, Julio; Monge, M. Angeles
Journal of publication	CrystEngComm
Year of publication	2012
Journal volume	14
Journal issue	17
Pages of publication	5493
a	19.0301 ± 0.0014 Å
b	7.2336 ± 0.0005 Å
c	20.5002 ± 0.0015 Å
α	90°
β	106.629 ± 0.001°
γ	90°
Cell volume	2704 ± 0.3 Å³
Cell temperature	273 ± 2 K
Ambient diffraction temperature	273 ± 2 K
Number of distinct elements	5
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/n 1
Hall space group symbol	-P 2yac
Residual factor for all reflections	0.0583
Residual factor for significantly intense reflections	0.0461
Weighted residual factors for significantly intense reflections	0.1279
Weighted residual factors for all reflections included in the refinement	0.1344
Goodness-of-fit parameter for all reflections included in the refinement	1.058
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
180412 (current)	2016-03-26	cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/81.	7208167.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7208167.cif
64209	2012-08-11	cif/ Adding structures of 7208164, 7208165, 7208166, 7208167, 7208168 via cif-deposit CGI script.	7208167.cif