Crystallography Open Database

Information card for entry 7135566

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Coordinates	7135566.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	HIAM-204
Formula	C24 H15 Ca O5
Calculated formula	C24 H15 Ca O5
Title of publication	Hydrophobic Pores in a Calcium-Based MOF Enable One-Step Ethylene Purification from C₂H₂/CO₂/C₂H₄ Mixtures
Authors of publication	Mao, Shanshan; Miao, Jiafeng; Zhou, Kang; Yin, Li; Guo, Fu-An; Hei, Xiuze; Wang, Hao
Journal of publication	Chemical Communications
Year of publication	2026
a	21.598 ± 0.006 Å
b	6.9255 ± 0.0015 Å
c	16.482 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	2465.3 ± 1 Å³
Cell temperature	200 K
Ambient diffraction temperature	200 K
Number of distinct elements	4
Space group number	55
Hermann-Mauguin space group symbol	P b a m
Hall space group symbol	-P 2 2ab
Residual factor for all reflections	0.1199
Residual factor for significantly intense reflections	0.0805
Weighted residual factors for significantly intense reflections	0.2065
Weighted residual factors for all reflections included in the refinement	0.2457
Goodness-of-fit parameter for all reflections included in the refinement	0.997
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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