Crystallography Open Database

Information card for entry 4349116

Preview

Coordinates	4349116.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C8 H3 Au2 F Fe N6
Calculated formula	C8 Au2 F Fe N6
Title of publication	Strong Cooperative Spin Crossover in 2D and 3D Fe<sup>II</sup>-M<sup>I,II</sup> Hofmann-Like Coordination Polymers Based on 2-Fluoropyrazine.
Authors of publication	Valverde-Muñoz, Francisco Javier; Seredyuk, Maksym; Muñoz, M Carmen; Znovjyak, Kateryna; Fritsky, Igor O.; Real, José Antonio
Journal of publication	Inorganic chemistry
Year of publication	2016
Journal volume	55
Journal issue	20
Pages of publication	10654 - 10665
a	7.1107 ± 0.001 Å
b	10.1715 ± 0.0013 Å
c	17.657 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	1277.1 ± 0.3 Å³
Cell temperature	120 ± 1 K
Ambient diffraction temperature	120 ± 1 K
Number of distinct elements	6
Space group number	64
Hermann-Mauguin space group symbol	C m c e
Hall space group symbol	-C 2ac 2
Residual factor for all reflections	0.0825
Residual factor for significantly intense reflections	0.0516
Weighted residual factors for significantly intense reflections	0.0908
Weighted residual factors for all reflections included in the refinement	0.1097
Goodness-of-fit parameter for all reflections included in the refinement	0.885
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
233590 (current)	2019-11-23	cif/ Adding structures of 4349116 via cif-deposit CGI script.	4349116.cif