Crystallography Open Database

Information card for entry 7236658

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Coordinates	7236658.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H12 Cu In N4 O8
Calculated formula	C24 H12 Cu In N4 O8
Title of publication	Tetrahedral crosslinking of dia-type nets into a zeolitic GIS-type framework for optimizing stability and gas sorption
Authors of publication	Tan, Yan-Xi; Si, Yanan; Wang, Wenjing; Yuan, Daqiang
Journal of publication	Journal of Materials Chemistry A
Year of publication	2017
Journal volume	5
Journal issue	44
Pages of publication	23276
a	28.99097 ± 0.00007 Å
b	28.99097 ± 0.00007 Å
c	16.7159 ± 0.00011 Å
α	90°
β	90°
γ	90°
Cell volume	14049.3 ± 0.1 Å³
Cell temperature	100 ± 0.3 K
Ambient diffraction temperature	100 ± 0.3 K
Number of distinct elements	6
Space group number	142
Hermann-Mauguin space group symbol	I 41/a c d :2
Hall space group symbol	-I 4bd 2c
Residual factor for all reflections	0.0463
Residual factor for significantly intense reflections	0.0452
Weighted residual factors for significantly intense reflections	0.1093
Weighted residual factors for all reflections included in the refinement	0.1099
Goodness-of-fit parameter for all reflections included in the refinement	1.18
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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