Crystallography Open Database

Information card for entry 1571469

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Coordinates	1571469.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	InOF-1_300K
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	15.4732 ± 0.00014 Å
b	15.4732 ± 0.00014 Å
c	12.3324 ± 0.00017 Å
α	90°
β	90°
γ	90°
Cell volume	2952.62 ± 0.06 Å³
Cell temperature	300.1 ± 0.18 K
Ambient diffraction temperature	300.1 ± 0.18 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	0.0226
Residual factor for significantly intense reflections	0.0217
Weighted residual factors for significantly intense reflections	0.062
Weighted residual factors for all reflections included in the refinement	0.0624
Goodness-of-fit parameter for all reflections included in the refinement	1.163
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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