Crystallography Open Database

Information card for entry 1571466

Preview

Coordinates	1571466.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	InOF-1_150K
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
Journal volume	11
Journal issue	14
Pages of publication	3345 - 3351
a	15.4819 ± 0.0002 Å
b	15.4819 ± 0.0002 Å
c	12.3361 ± 0.0003 Å
α	90°
β	90°
γ	90°
Cell volume	2956.83 ± 0.09 Å³
Cell temperature	150.01 ± 0.1 K
Ambient diffraction temperature	150 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	0.022
Residual factor for significantly intense reflections	0.0214
Weighted residual factors for significantly intense reflections	0.0599
Weighted residual factors for all reflections included in the refinement	0.0602
Goodness-of-fit parameter for all reflections included in the refinement	1.158
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
293946 (current)	2024-08-05	cif/ Updating files of 1571464, 1571465, 1571466, 1571467, 1571468, 1571469 Original log message: Adding full bibliography for 1571464--1571469.cif.	1571466.cif
291287	2024-04-19	cif/ Adding structures of 1571464, 1571465, 1571466, 1571467, 1571468, 1571469 via cif-deposit CGI script.	1571466.cif