Crystallography Open Database

Information card for entry 2300381

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Coordinates	2300381.cif
Original IUCr paper	HTML

Structure parameters

Common name	HKUST-1
Formula	C33 H4 Cu2 O10
Calculated formula	C33 H4 Cu2 O10
Title of publication	Generation and applications of structure envelopes for porous metal‒organic frameworks
Authors of publication	Yakovenko, Andrey A.; Reibenspies, Joseph H.; Bhuvanesh, Nattamai; Zhou, Hong-Cai
Journal of publication	Journal of Applied Crystallography
Year of publication	2013
Journal volume	46
Journal issue	2
Pages of publication	346 - 353
a	26.3167 ± 0.0011 Å
b	26.3167 ± 0.0011 Å
c	26.3167 ± 0.0011 Å
α	90°
β	90°
γ	90°
Cell volume	18226.1 ± 1.3 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	4
Space group number	225
Hermann-Mauguin space group symbol	F m -3 m
Hall space group symbol	-F 4 2 3
Residual factor R(I) for significantly intense reflections	0.0682
Goodness-of-fit parameter for all reflections	1.64
Method of determination	powder diffraction
Diffraction radiation wavelength	0.45875 Å
Diffraction radiation type	synchrotron
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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