Crystallography Open Database

Information card for entry 7703668

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Coordinates	7703668.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H20 Co K N8
Calculated formula	C12 H20 Co K N8
Title of publication	Structural phase transitions coupled with prominent dielectric anomalies and dielectric relaxation in [(CH<sub>3</sub>)<sub>3</sub>NH]<sub>2</sub>[KCo(CN)<sub>6</sub>] and mixed [(CH<sub>3</sub>)<sub>3</sub>NH]<sub>2</sub>[KFe<sub>x</sub>Co<sub>1-x</sub>(CN)<sub>6</sub>] double perovskite hybrids.
Authors of publication	Rok, Magdalena; Zarychta, Bartosz; Moskwa, Marcin; Dziuk, Błażej; Medycki, Wojciech; Bator, Grażyna
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	6
Pages of publication	1830 - 1838
a	15.2965 ± 0.0005 Å
b	8.4134 ± 0.0002 Å
c	13.8289 ± 0.0004 Å
α	90°
β	107.437 ± 0.004°
γ	90°
Cell volume	1697.93 ± 0.09 Å³
Cell temperature	100 ± 0.1 K
Ambient diffraction temperature	100 ± 0.1 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0258
Residual factor for significantly intense reflections	0.0233
Weighted residual factors for significantly intense reflections	0.063
Weighted residual factors for all reflections included in the refinement	0.0649
Goodness-of-fit parameter for all reflections included in the refinement	1.036
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
248772 (current)	2020-03-04	cif/ Adding structures of 7703668, 7703669 via cif-deposit CGI script.	7703668.cif