Crystallography Open Database

Information card for entry 4515384

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Coordinates	4515384.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C5 H6 Mn O8
Calculated formula	C5 H6 Mn O8
Title of publication	Transition-Metal-Triggered High-Efficiency Lithium Ion Storage via Coordination Interactions with Redox-Active Croconate in One-Dimensional Metal-Organic Anode Materials.
Authors of publication	Zhang, Lin; Cheng, Fangyi; Shi, Wei; Chen, Jun; Cheng, Peng
Journal of publication	ACS applied materials & interfaces
Year of publication	2018
Journal volume	10
Journal issue	7
Pages of publication	6398 - 6406
a	11.9302 ± 0.0003 Å
b	8.1807 ± 0.00016 Å
c	15.6895 ± 0.0003 Å
α	90°
β	90°
γ	90°
Cell volume	1531.25 ± 0.06 Å³
Cell temperature	120.65 ± 0.1 K
Ambient diffraction temperature	120.65 ± 0.1 K
Number of distinct elements	4
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0344
Residual factor for significantly intense reflections	0.0295
Weighted residual factors for significantly intense reflections	0.0705
Weighted residual factors for all reflections included in the refinement	0.0742
Goodness-of-fit parameter for all reflections included in the refinement	1.084
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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