Crystallography Open Database

Information card for entry 8106091

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Coordinates	8106091.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H28 F2 Mn N4 O6
Calculated formula	C38 H28 F2 Mn N4 O6
Title of publication	Crystal Structure of bis(2-fluorbenzoato-κO)-bis(1,10-phenanthroline-κ2 N,N′)manganese(II) dihydrate, C38H28F2MnN4O6
Authors of publication	Jin, Zhu-Nian; Zhang, Bi-Song
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2018
Journal volume	233
Journal issue	2
Pages of publication	179 - 181
a	11.071 ± 0.0003 Å
b	25.4046 ± 0.0007 Å
c	11.7681 ± 0.0003 Å
α	90°
β	93.496 ± 0.001°
γ	90°
Cell volume	3303.67 ± 0.15 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.0838
Residual factor for significantly intense reflections	0.054
Weighted residual factors for significantly intense reflections	0.1329
Weighted residual factors for all reflections included in the refinement	0.1504
Goodness-of-fit parameter for all reflections included in the refinement	1.071
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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