Crystallography Open Database

Information card for entry 4341854

Preview

Coordinates	4341854.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C34 H16 F12 Mn2 O8
Calculated formula	C34 H16 F12 Mn2 O8
Title of publication	Unusual Magnetic Behaviors and Electronic Configurations Driven by Diverse Co(II) or Mn(II) MOF Architectures.
Authors of publication	Bernini, María Celeste; de Paz, Julio Romero; Snejko, Natalia; Sáez-Puche, Regino; Gutierrez-Puebla, Enrique; Monge, María Ángeles
Journal of publication	Inorganic chemistry
Year of publication	2014
Pages of publication	141204082337009
a	28.5047 ± 0.0003 Å
b	28.5047 ± 0.0003 Å
c	10.5027 ± 0.0003 Å
α	90°
β	90°
γ	90°
Cell volume	8533.6 ± 0.3 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296.15 K
Number of distinct elements	5
Space group number	88
Hermann-Mauguin space group symbol	I 41/a
Hall space group symbol	-I 4ad
Residual factor for all reflections	0.0448
Residual factor for significantly intense reflections	0.0392
Weighted residual factors for significantly intense reflections	0.1159
Weighted residual factors for all reflections included in the refinement	0.1192
Goodness-of-fit parameter for all reflections included in the refinement	1.124
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179521 (current)	2016-03-24	cif/4/34/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/34/18.	4341854.cif
128254	2014-12-06	cif/ Adding structures of 4341854 via cif-deposit CGI script.	4341854.cif