Crystallography Open Database

Information card for entry 4335550

Preview

Coordinates	4335550.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C37 H32 Mn N10 O4 W
Calculated formula	C37 H32 Mn N10 O4 W
Title of publication	Cyanide-Bridged WVMnIII Bimetallic Chains Composed of a Blocked W Hexacyanide Precursor: Geometry-Related Magnetic Couplings and Magnetostructural Correlation
Authors of publication	Jin Wuk Lee; Kwang Soo Lim; Dae Won Ryu; Eui Kwan Koh; Sung Won Yoon; Byoung Jin Suh; Chang Seop Hong
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	8677 - 8684
a	9.2036 ± 0.0002 Å
b	21.1875 ± 0.0005 Å
c	18.0645 ± 0.0004 Å
α	90°
β	92.853 ± 0.001°
γ	90°
Cell volume	3518.23 ± 0.14 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.1072
Residual factor for significantly intense reflections	0.0464
Weighted residual factors for significantly intense reflections	0.0629
Weighted residual factors for all reflections included in the refinement	0.073
Goodness-of-fit parameter for all reflections included in the refinement	0.866
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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