Crystallography Open Database

Information card for entry 4104957

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Structure parameters

Formula	C6 H2 Cu O4
Calculated formula	C6 H2 Cu O4
Title of publication	Exceptionally High Acetylene Uptake in a Microporous Metal-Organic Framework with Open Metal Sites
Authors of publication	Shengchang Xiang; Wei Zhou; Jose M. Gallegos; Yun Liu; Banglin Chen
Journal of publication	Journal of the American Chemical Society
Year of publication	2009
Journal volume	131
Pages of publication	12415 - 12419
a	26.28791 ± 0.00029 Å
b	26.28791 Å
c	26.28791 Å
α	90°
β	90°
γ	90°
Cell volume	18166.4 ± 0.2 Å³
Cell temperature	4 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
RFsqd	0.06467
Goodness-of-fit parameter for all reflections	0.91
Method of determination	powder diffraction
Diffraction radiation probe	neutron
Diffraction radiation wavelength	2.0782 Å
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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