Crystallography Open Database

Information card for entry 4001800

Preview

Coordinates	4001800.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C288 H192 Cu48 I108.75 O240
Calculated formula	C288 H192 Cu48 I108.75 O240
Title of publication	Competitive I2Sorption by Cu-BTC from Humid Gas Streams
Authors of publication	Sava, Dorina F.; Chapman, Karena W.; Rodriguez, Mark A.; Greathouse, Jeffery A.; Crozier, Paul S.; Zhao, Haiyan; Chupas, Peter J.; Nenoff, Tina M.
Journal of publication	Chemistry of Materials
Year of publication	2013
Journal volume	25
Journal issue	13
Pages of publication	2591
a	25.9981 Å
b	26.2767 Å
c	26.5511 Å
α	90°
β	90°
γ	90°
Cell volume	18138.2 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
Space group number	1
Hermann-Mauguin space group symbol	P 1
Hall space group symbol	P 1
Diffraction radiation wavelength	0.2128 Å
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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