Crystallography Open Database

Information card for entry 2202342

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Structure parameters

Chemical name	Pentapotassium dicitrato(4-)manganate(III) pentahydrate
Formula	C12 H18 K5 Mn O19
Calculated formula	C12 H18 K5 Mn O19
SMILES	[Mn]1234(OC(=O)C(O2)(CC(=O)O1)CC(=O)[O-])OC(=O)C(O3)(CC(=O)O4)CC(=O)[O-].[K+].[K+].[K+].[K+].[K+].O.O.O.O.O
Title of publication	Pentapotassium dicitrato(4{-})manganate(III) pentahydrate
Authors of publication	Zhao, Rui; Deng, Yuan-Fu; Zhou, Zhao-Hui; Ng, Seik Weng
Journal of publication	Acta Crystallographica Section E
Year of publication	2003
Journal volume	59
Journal issue	8
Pages of publication	m666 - m668
a	6.8304 ± 0.0004 Å
b	9.227 ± 0.0005 Å
c	20.197 ± 0.001 Å
α	78.294 ± 0.001°
β	82.734 ± 0.001°
γ	74.892 ± 0.001°
Cell volume	1199.69 ± 0.11 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0786
Residual factor for significantly intense reflections	0.0624
Weighted residual factors for significantly intense reflections	0.1501
Weighted residual factors for all reflections included in the refinement	0.161
Goodness-of-fit parameter for all reflections included in the refinement	1.149
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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