Crystallography Open Database: Information card for 7000305

Structure parameters

Formula	Cl H56 Mo8 N12 O56 P9
Calculated formula	Cl H56 Mo8 N12 O56 P9
Title of publication	[NH4]12[(MoO2)2O(HPO4)2]4[PO4]X, X = Cl, Br‒-new porous layer molybdenophosphates with embedded multiple anionic and cationic guests
Authors of publication	Kotsapa, Eleni; Weller, Mark T.
Journal of publication	Dalton Transactions
Year of publication	2009
Journal issue	3
Pages of publication	418 - 420
a	9.7148 ± 0.0001 Å
b	9.7148 ± 0.0001 Å
c	14.5615 ± 0.0003 Å
α	90°
β	90°
γ	90°
Cell volume	1374.28 ± 0.03 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	6
Hermann-Mauguin symmetry space group	P -4
Hall symmetry space group	P -4
Residual factor for all reflections	0.0267
Residual factor for observed reflections	0.0264
Weighted residual factors for the observed reflections	0.0627
Weighted residual factors for all reflections included in the refinement	0.0628
Goodness-of-fit parameter for observed reflections	1.133
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Crystallography Open Database