Crystallography Open Database

Information card for entry 7046113

Preview

Coordinates	7046113.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C23 H13 Mn N3 O4
Calculated formula	C23 H13 Mn N3 O4
Title of publication	Solvent-dependent variations of both structure and catalytic performance in three manganese coordination polymers.
Authors of publication	Kang, Xiao-Min; Wang, Wen-Min; Yao, Lin-Hong; Ren, Hong-Xia; Zhao, Bin
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2018
Journal volume	47
Journal issue	20
Pages of publication	6986 - 6994
a	17.3875 ± 0.0012 Å
b	17.3875 ± 0.0012 Å
c	18.3017 ± 0.0009 Å
α	90°
β	90°
γ	90°
Cell volume	5533.1 ± 0.6 Å³
Cell temperature	177 ± 30 K
Ambient diffraction temperature	177 ± 30 K
Number of distinct elements	5
Space group number	92
Hermann-Mauguin space group symbol	P 41 21 2
Hall space group symbol	P 4abw 2nw
Residual factor for all reflections	0.1021
Residual factor for significantly intense reflections	0.0676
Weighted residual factors for significantly intense reflections	0.1181
Weighted residual factors for all reflections included in the refinement	0.1324
Goodness-of-fit parameter for all reflections included in the refinement	0.98
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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