Crystallography Open Database

Information card for entry 4517860

Preview

Coordinates	4517860.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H57 Na O31
Calculated formula	C36 H57 Na O31
Title of publication	Metal-Organic Framework Based on α-Cyclodextrin Gives High Ethylene Gas Adsorption Capacity and Storage Stability.
Authors of publication	Li, Han; Shi, Linfan; Li, Chao; Fu, Xiong; Huang, Qiang; Zhang, Bin
Journal of publication	ACS applied materials & interfaces
Year of publication	2020
Journal volume	12
Journal issue	30
Pages of publication	34095 - 34104
a	11.5709 ± 0.0001 Å
b	15.9742 ± 0.0001 Å
c	26.5954 ± 0.0001 Å
α	90°
β	90°
γ	90°
Cell volume	4915.78 ± 0.06 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
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	0.047
Residual factor for significantly intense reflections	0.0468
Weighted residual factors for significantly intense reflections	0.1386
Weighted residual factors for all reflections included in the refinement	0.1388
Goodness-of-fit parameter for all reflections included in the refinement	1.097
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
256984 (current)	2020-10-04	cif/ Updating files of 4517859, 4517860 Original log message: Adding full bibliography for 4517859--4517860.cif.	4517860.cif
254762	2020-08-04	cif/ Updating files of 4517859, 4517860 Original log message: Adding full bibliography for 4517859--4517860.cif.	4517860.cif
254405	2020-07-21	cif/ Adding structures of 4517860 via cif-deposit CGI script.	4517860.cif