Crystallography Open Database

Information card for entry 4108533

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Coordinates	4108533.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	MIL-53 ortho-xylene
Formula	C8 H5 Al O5
Calculated formula	C18.88 Al O
Title of publication	Selective Adsorption and Separation of ortho-Substituted Alkylaromatics with the Microporous Aluminum Terephthalate MIL-53
Authors of publication	Luc Alaerts; Michael Maes; Lars Giebeler; Pierre A. Jacobs; Johan A. Martens; Joeri F. M. Denayer; Christine E. A. Kirschhock; Dirk E. De Vos
Journal of publication	Journal of the American Chemical Society
Year of publication	2008
Journal volume	130
Pages of publication	14170 - 14178
a	6.63098 ± 0.00022 Å
b	15.9473 ± 0.0007 Å
c	13.9205 ± 0.0006 Å
α	90°
β	90°
γ	90°
Cell volume	1472.04 ± 0.1 Å³
Number of distinct elements	4
Space group number	74
Hermann-Mauguin space group symbol	I m m a
Hall space group symbol	-I 2b 2
Goodness-of-fit parameter for all reflections	4.55
Method of determination	powder diffraction
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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