Crystallography Open Database

Information card for entry 1565633

Preview

Coordinates	1565633.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H28 N2 O9 Zn
Calculated formula	C28 H28 N2 O9 Zn
Title of publication	Benzoate substituents effects on the structure of Zn(II) complexes and 1D 4,4′-bipyridine derived coordination polymers
Authors of publication	Sánchez-Férez, Francisco; Pou, Roger; Bayés-García, Laura; Font-Bardia, Mercè; Pons, Josefina; Ayllón, José A.
Journal of publication	Inorganica Chimica Acta
Year of publication	2020
Journal volume	500
Pages of publication	119218
a	23.016 ± 0.0014 Å
b	27.8171 ± 0.0015 Å
c	8.7942 ± 0.0005 Å
α	90°
β	102.896 ± 0.002°
γ	90°
Cell volume	5488.4 ± 0.5 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0686
Residual factor for significantly intense reflections	0.0406
Weighted residual factors for significantly intense reflections	0.0868
Weighted residual factors for all reflections included in the refinement	0.0958
Goodness-of-fit parameter for all reflections included in the refinement	1.049
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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