Crystallography Open Database

Information card for entry 4344925

Preview

Coordinates	4344925.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H12 Cu5 I2 N4 O18
Calculated formula	C28 H12 Cu5 I2 N4 O18
Title of publication	Reticular Synthesis of a Series of HKUST-like MOFs with Carbon Dioxide Capture and Separation
Authors of publication	He, Hongming; Sun, Fuxing; Ma, Shengqian; Zhu, Guangshan
Journal of publication	Inorganic Chemistry
Year of publication	2016
Journal volume	55
Journal issue	17
Pages of publication	9071 - 9076
a	21.2731 ± 0.0005 Å
b	25.7339 ± 0.0006 Å
c	27.1818 ± 0.0007 Å
α	90°
β	90°
γ	90°
Cell volume	14880.4 ± 0.6 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	69
Hermann-Mauguin space group symbol	F m m m
Hall space group symbol	-F 2 2
Residual factor for all reflections	0.1156
Residual factor for significantly intense reflections	0.1099
Weighted residual factors for significantly intense reflections	0.2954
Weighted residual factors for all reflections included in the refinement	0.3031
Goodness-of-fit parameter for all reflections included in the refinement	1.072
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
275238 (current)	2022-05-09	cif/4/34/49/ Updated bibliographic information in entries 4344923-4344925.	4344925.cif
189234	2016-12-19	cif/ Adding structures of 4344925 via cif-deposit CGI script.	4344925.cif