Crystallography Open Database

Information card for entry 7235965

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Coordinates	7235965.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C9 H14 Cu2 N4 O10
Calculated formula	C9 H8 Cu2 N4 O10
Title of publication	Spin-canting magnetization in 3D metal organic frameworks based on strip-shaped Δ-chains
Authors of publication	Zhang, Xiu-Mei; Li, Peng; Gao, Wei; Liu, Jie-Ping
Journal of publication	RSC Advances
Year of publication	2015
Journal volume	5
Journal issue	94
Pages of publication	76752
a	10.015 ± 0.0009 Å
b	6.6124 ± 0.0005 Å
c	12.4721 ± 0.0011 Å
α	90°
β	109.412 ± 0.002°
γ	90°
Cell volume	778.99 ± 0.11 Å³
Cell temperature	571 ± 2 K
Ambient diffraction temperature	571 ± 2 K
Number of distinct elements	5
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	0.1726
Residual factor for significantly intense reflections	0.105
Weighted residual factors for significantly intense reflections	0.2335
Weighted residual factors for all reflections included in the refinement	0.2989
Goodness-of-fit parameter for all reflections included in the refinement	1.002
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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