Crystallography Open Database

Information card for entry 4519220

4519219 << 4519220 >> 4519221

Preview

Coordinates	4519220.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	Co-TATB
Formula	C24 H12 Cl0.25 Co1.5 N3 O6
Calculated formula	C24 H12 Cl0.25 Co1.5 N3 O6
Title of publication	Template-Directed Fabrication of Highly Efficient Metal-Organic Framework Photocatalysts.
Authors of publication	Liu, Wansheng; Yang, Yi; Yang, Xiaojie; Peng, Yun-Lei; Cheng, Peng; Zhang, Zhenjie; Chen, Yao
Journal of publication	ACS applied materials & interfaces
Year of publication	2021
Journal volume	13
Journal issue	49
Pages of publication	58619 - 58629
a	17.9001 ± 0.0016 Å
b	17.9001 ± 0.0016 Å
c	26.387 ± 0.005 Å
α	90°
β	90°
γ	90°
Cell volume	8454.8 ± 1.9 Å³
Cell temperature	120 K
Ambient diffraction temperature	120 K
Number of distinct elements	6
Space group number	91
Hermann-Mauguin space group symbol	P 41 2 2
Hall space group symbol	P 4w 2c
Residual factor for all reflections	0.1759
Residual factor for significantly intense reflections	0.106
Weighted residual factors for significantly intense reflections	0.2465
Weighted residual factors for all reflections included in the refinement	0.2959
Goodness-of-fit parameter for all reflections included in the refinement	0.977
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
271716 (current)	2022-01-03	cif/ Adding structures of 4519220 via cif-deposit CGI script.	4519220.cif