Crystallography Open Database

Information card for entry 7110125

Preview

Coordinates	7110125.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C8 H16.8 Cu2 N4 O7.4
Calculated formula	C8 H16.8 Cu2 N4 O7.4
Title of publication	A flexible porous Cu(II) bis-imidazolate framework with ultrahigh concentration of active sites for efficient and recyclable CO2 capture
Authors of publication	Dong-Dong Zhou; Chun-Ting He; Pei-Qin Liao; Wei Xue; Wei-Xiong Zhang; Hao-Long Zhou; Jie-Peng Zhang; Xiao-Ming Chen
Journal of publication	Chem.Commun.
Year of publication	2013
Journal volume	49
Pages of publication	11728
a	10.7521 ± 0.0008 Å
b	11.7077 ± 0.0007 Å
c	12.3439 ± 0.001 Å
α	90°
β	92.146 ± 0.007°
γ	90°
Cell volume	1552.79 ± 0.19 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 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	0.1011
Residual factor for significantly intense reflections	0.0946
Weighted residual factors for significantly intense reflections	0.279
Weighted residual factors for all reflections included in the refinement	0.2837
Goodness-of-fit parameter for all reflections included in the refinement	1.046
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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