Crystallography Open Database

Information card for entry 4315774

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Coordinates	4315774.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	Trisodium Copper(ii) nitrate pyrophosphate, trihydrate
Formula	Cu H6 N Na3 O13 P2
Calculated formula	Cu H6 N Na3 O13 P2
Title of publication	Pyrophosphate-Bridged CuII Chain Magnet: {[Na3Cu(P2O7)(NO3)].3H2O}n
Authors of publication	Rosana P. Sartoris; Ricardo C. Santana; Ricardo F. Baggio; Octavio Peña; Mireille Perec; Rafael Calvo
Journal of publication	Inorganic Chemistry
Year of publication	2010
Journal volume	49
Pages of publication	5650 - 5657
a	7.2492 ± 0.0005 Å
b	8.2446 ± 0.0006 Å
c	9.905 ± 0.0007 Å
α	90°
β	107.123 ± 0.001°
γ	90°
Cell volume	565.75 ± 0.07 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	11
Hermann-Mauguin space group symbol	P 1 21/m 1
Hall space group symbol	-P 2yb
Residual factor for all reflections	0.0184
Residual factor for significantly intense reflections	0.0181
Weighted residual factors for significantly intense reflections	0.0487
Weighted residual factors for all reflections included in the refinement	0.0489
Goodness-of-fit parameter for all reflections included in the refinement	1.077
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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