Crystallography Open Database

Information card for entry 4328698

Preview

Coordinates	4328698.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C82 H76 Fe2 Mn2 N16 O10
Calculated formula	C82 H76 Fe2 Mn2 N16 O10
Title of publication	Cyanido-Bridged Fe(III)-Mn(III) Heterobimetallic Materials Built From Mn(III) Schiff Base Complexes and Di- or Tri-Cyanido Fe(III) Precursors
Authors of publication	Tapas Senapati; Céline Pichon; Rodica Ababei; Corine Mathonière; Rodolphe Clérac
Journal of publication	Inorganic Chemistry
Year of publication	2012
Journal volume	51
Pages of publication	3796 - 3812
a	17.205 ± 0.003 Å
b	17.308 ± 0.004 Å
c	25.966 ± 0.005 Å
α	91.54 ± 0.03°
β	91.5 ± 0.03°
γ	105.14 ± 0.03°
Cell volume	7457 ± 3 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 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	0.1166
Residual factor for significantly intense reflections	0.0896
Weighted residual factors for significantly intense reflections	0.2283
Weighted residual factors for all reflections included in the refinement	0.2506
Goodness-of-fit parameter for all reflections included in the refinement	1.268
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
179389 (current)	2016-03-23	cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/86.	4328698.cif
77692	2013-03-29	cif/ Adding structures of 4328698 via cif-deposit CGI script.	4328698.cif