Crystallography Open Database

Information card for entry 1571464

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Coordinates	1571464.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	InOF-1_110K
Formula	C8 H3 In O5
Calculated formula	C8 H3 In O5
Title of publication	Biphenyl Tetracarboxylic Acid based Metal-Organic Frameworks: A Case of Topology-Dependent Thermal Expansion
Authors of publication	Liu, Zhanning; Xing, Chengyong; Wu, Shaowen; Ma, Min; Tian, Jian
Journal of publication	Materials Horizons
Year of publication	2024
a	15.4846 ± 0.0003 Å
b	15.4846 ± 0.0003 Å
c	12.3372 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	2958.13 ± 0.13 Å³
Cell temperature	114 ± 3 K
Ambient diffraction temperature	110 K
Number of distinct elements	4
Space group number	98
Hermann-Mauguin space group symbol	I 41 2 2
Hall space group symbol	I 4bw 2bw
Residual factor for all reflections	0.0247
Residual factor for significantly intense reflections	0.0241
Weighted residual factors for significantly intense reflections	0.0631
Weighted residual factors for all reflections included in the refinement	0.0638
Goodness-of-fit parameter for all reflections included in the refinement	1.128
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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