Crystallography Open Database

Information card for entry 2022120

2022119 << 2022120 >> 2022121

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Structure parameters

Chemical name	Poly[[(μ~4~-biphenyl-2,2',5,5'-tetracarboxylato)bis{[1,4-πhenylenebis(methylene)]bis(1<i>H</i>-imidazole)}dizinc(II)] monohydrate]
Formula	C44 H36 N8 O9 Zn2
Calculated formula	C44 H36 N8 O9 Zn2
Title of publication	Two Zn^II^-based MOFs constructed with biphenyl-2,2',5,5'-tetracarboxylic acid and flexible N-donor ligands: syntheses, structures and properties
Authors of publication	Su, Feng; Yu, Jinyang; Zhou, Chengyong; Li, Shaodong; Ma, Pengyi; Zhang, Xuhui; Wang, Zhijun
Journal of publication	Acta Crystallographica Section C
Year of publication	2020
Journal volume	76
Journal issue	6
a	12.436 ± 0.0007 Å
b	24.0412 ± 0.0013 Å
c	28.4613 ± 0.0015 Å
α	90°
β	90°
γ	90°
Cell volume	8509.3 ± 0.8 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	43
Hermann-Mauguin space group symbol	F d d 2
Hall space group symbol	F 2 -2d
Residual factor for all reflections	0.0717
Residual factor for significantly intense reflections	0.0508
Weighted residual factors for significantly intense reflections	0.1201
Weighted residual factors for all reflections included in the refinement	0.1325
Goodness-of-fit parameter for all reflections included in the refinement	1.006
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

Version history

Revision	Date	Message	Files
252050 (current)	2020-05-14	cif/ hkl/ Adding structures of 2022119, 2022120 via cif-deposit CGI script.	2022120.cif 2022120.hkl