Crystallography Open Database

Information card for entry 1568298

Preview

Coordinates	1568298.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H50 F14 Fe6 N6 O20
Calculated formula	C36 H50 F14 Fe6 N6 O20
Title of publication	Fluorido-bridged robust metal-organic frameworks for efficient C<sub>2</sub>H<sub>2</sub>/CO<sub>2</sub> separation under moist conditions.
Authors of publication	Gu, Yi-Ming; Yuan, You-You; Chen, Cai-Lin; Zhao, Sheng-Sheng; Sun, Tian-Jun; Han, Yu; Liu, Xiao-Wei; Lai, Zhiping; Wang, Shu-Dong
Journal of publication	Chemical science
Year of publication	2023
Journal volume	14
Journal issue	6
Pages of publication	1472 - 1478
a	16.8365 ± 0.0011 Å
b	18.0784 ± 0.0013 Å
c	20.746 ± 0.0012 Å
α	90°
β	90°
γ	90°
Cell volume	6314.6 ± 0.7 Å³
Cell temperature	110.15 K
Ambient diffraction temperature	110.15 K
Number of distinct elements	6
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	0.1092
Residual factor for significantly intense reflections	0.0668
Weighted residual factors for significantly intense reflections	0.1487
Weighted residual factors for all reflections included in the refinement	0.1689
Goodness-of-fit parameter for all reflections included in the refinement	1.034
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
281371 (current)	2023-03-04	cif/ Updating files of 1568298 Original log message: Adding full bibliography for 1568298.cif.	1568298.cif
280421	2023-01-19	cif/ Adding structures of 1568298 via cif-deposit CGI script.	1568298.cif