Crystallography Open Database

Information card for entry 7056819

Preview

Coordinates	7056819.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Fe(2-MIm)2[Fe(CN)5NO]2H2O
Chemical name	Iron bis-2-methylimidazole Nitrosylpentacyanoferrate (III) dihydrate
Formula	C26 Fe4 N20 O6
Calculated formula	C13 Fe2 N10 O2
Title of publication	New coordination polymers based on 2-methylimidazole and transition metal nitroprusside containing building blocks: synthesis, structure and magnetic properties
Authors of publication	Di Santo, A.; Osiry, H.; Reguera, E.; Alborés, P.; Carbonio, R. E.; Ben Altabef, A.; Gil, Diego M.
Journal of publication	New Journal of Chemistry
Year of publication	2018
Journal volume	42
Journal issue	2
Pages of publication	1347
a	19.0271 ± 0.0004 Å
b	14.9773 ± 0.0005 Å
c	7.249 ± 0.0001 Å
α	90°
β	90°
γ	90°
Cell volume	2065.78 ± 0.09 Å³
Cell temperature	298 K
Ambient diffraction temperature	298 K
Number of distinct elements	4
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for significantly intense reflections	0.0922
Weighted residual factors for all reflections included in the refinement	0.127
Residual factor R(I) for significantly intense reflections	11.633
Goodness-of-fit parameter for all reflections	1.191
Method of determination	powder diffraction
Diffraction radiation wavelength	1.5406 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
230306 (current)	2019-11-17	cif/ Updating files of 7056816, 7056817, 7056818, 7056819 Original log message: Adding full bibliography for 7056816--7056819.cif.	7056819.cif
204306	2017-12-16	cif/ Adding structures of 7056816, 7056817, 7056818, 7056819 via cif-deposit CGI script.	7056819.cif