Crystallography Open Database

Information card for entry 7054430

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Coordinates	7054430.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H31 Fe Mn N9 O6
Calculated formula	C36 H31 Fe Mn N9 O6
Title of publication	Crystal structures and magneto-structural correlation analysis for several cyano-bridged bimetallic complexes based on MnIII‒FeIIIsystems
Authors of publication	Zhou, Hongbo; Wang, Yingying; Mou, Fangyou; Shen, Xiaoping; Liu, Yashu
Journal of publication	New J. Chem.
Year of publication	2014
Journal volume	38
Journal issue	12
Pages of publication	5925
a	11.415 ± 0.005 Å
b	13.273 ± 0.005 Å
c	14.081 ± 0.006 Å
α	65.735 ± 0.004°
β	67.531 ± 0.004°
γ	71.71 ± 0.005°
Cell volume	1765.9 ± 1.3 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 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	0.1037
Residual factor for significantly intense reflections	0.0678
Weighted residual factors for significantly intense reflections	0.1457
Weighted residual factors for all reflections included in the refinement	0.1639
Goodness-of-fit parameter for all reflections included in the refinement	0.993
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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