Crystallography Open Database

Information card for entry 4515326

Preview

Coordinates	4515326.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H16 N2 Ni O7.33 Zr
Calculated formula	C22 H16 N2 Ni O7.33333 Zr
Title of publication	Highly Stable Chiral Zirconium-Metallosalen Frameworks for CO<sub>2</sub> Conversion and Asymmetric C-H Azidation.
Authors of publication	Li, Jiawei; Ren, Yanwei; Yue, Chenglong; Fan, Yamei; Qi, Chaorong; Jiang, Huanfeng
Journal of publication	ACS applied materials & interfaces
Year of publication	2018
Journal volume	10
Journal issue	42
Pages of publication	36047 - 36057
a	31.7493 ± 0.0007 Å
b	31.7493 ± 0.0007 Å
c	31.7493 ± 0.0007 Å
α	90°
β	90°
γ	90°
Cell volume	32003.9 ± 1.2 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	209
Hermann-Mauguin space group symbol	F 4 3 2
Hall space group symbol	F 4 2 3
Residual factor for all reflections	0.1799
Residual factor for significantly intense reflections	0.1486
Weighted residual factors for significantly intense reflections	0.3643
Weighted residual factors for all reflections included in the refinement	0.4138
Goodness-of-fit parameter for all reflections included in the refinement	1.104
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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