Crystallography Open Database

Information card for entry 7244728

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Coordinates	7244728.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C44 H40 N4 O16 Zn3
Calculated formula	C44 H40 N4 O16 Zn3
Title of publication	Design Syntheses of Metal-Organic Layer with Rich N-sites for CO2 Chemical Fixation
Authors of publication	Wang, Zhi-Wen; Zhu, Zi-Yi; Li, Shangda; Wang, Fei
Journal of publication	CrystEngComm
Year of publication	2022
a	11.1793 ± 0.0001 Å
b	15.0014 ± 0.0002 Å
c	25.5008 ± 0.0002 Å
α	90°
β	90°
γ	90°
Cell volume	4276.62 ± 0.08 Å³
Cell temperature	99.99 ± 0.1 K
Ambient diffraction temperature	99.99 ± 0.1 K
Number of distinct elements	5
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0385
Residual factor for significantly intense reflections	0.0361
Weighted residual factors for significantly intense reflections	0.0889
Weighted residual factors for all reflections included in the refinement	0.0906
Goodness-of-fit parameter for all reflections included in the refinement	1.026
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.3405 Å
Diffraction radiation type	GaKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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