Crystallography Open Database

Information card for entry 7232438

Preview

Coordinates	7232438.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C84 H106 F32 O45 Zn8
Calculated formula	C71 H52 F32 O32 Zn8
Title of publication	Structural diversity of zinc(ii) coordination polymers with octafluorobiphenyl-4,4′-dicarboxylate based on mononuclear, paddle wheel and cuboidal units
Authors of publication	Cheplakova, Anastasia M.; Kovalenko, Konstantin A.; Samsonenko, Denis G.; Vinogradov, Andrey S.; Karpov, Victor M.; Platonov, Vyacheslav E.; Fedin, Vladimir P.
Journal of publication	CrystEngComm
Year of publication	2019
Journal volume	21
Journal issue	15
Pages of publication	2524
a	17.6709 ± 0.0004 Å
b	18.1755 ± 0.0007 Å
c	17.705 ± 0.0004 Å
α	90°
β	91.349 ± 0.002°
γ	90°
Cell volume	5684.9 ± 0.3 Å³
Cell temperature	130 ± 2 K
Ambient diffraction temperature	130 ± 2 K
Number of distinct elements	5
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0702
Residual factor for significantly intense reflections	0.067
Weighted residual factors for significantly intense reflections	0.1851
Weighted residual factors for all reflections included in the refinement	0.1882
Goodness-of-fit parameter for all reflections included in the refinement	1.032
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
223682 (current)	2019-11-07	cif/ Updating files of 7232433, 7232434, 7232435, 7232436, 7232437, 7232438 Original log message: Adding full bibliography for 7232433--7232438.cif.	7232438.cif
213801	2019-02-23	cif/ Adding structures of 7232433, 7232434, 7232435, 7232436, 7232437, 7232438 via cif-deposit CGI script.	7232438.cif