Crystallography Open Database

Information card for entry 7248889

Preview

Coordinates	7248889.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C17 H25 In2 N3 O16
Calculated formula	C17 H25 In2 N3 O16
Title of publication	Solvent-free synthesis and optical properties of two open-framework metal oxalates with zeolitic ABW and diamondoid topologies
Authors of publication	Guo, Shuxian; Liu, Sihan; Wen, Xuemei; Cheng, Juan; Wang, Xin; Zeng, Hongmei; Zou, Guohong; Lin, Zhien
Journal of publication	CrystEngComm
Year of publication	2024
Journal volume	26
Journal issue	26
Pages of publication	3463 - 3467
a	8.4592 ± 0.0005 Å
b	16.8623 ± 0.0005 Å
c	8.8757 ± 0.0004 Å
α	90°
β	99.942 ± 0.005°
γ	90°
Cell volume	1247.03 ± 0.1 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0198
Residual factor for significantly intense reflections	0.0188
Weighted residual factors for significantly intense reflections	0.0463
Weighted residual factors for all reflections included in the refinement	0.0466
Goodness-of-fit parameter for all reflections included in the refinement	1.044
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
292950 (current)	2024-07-05	cif/ Updating files of 7248888, 7248889 Original log message: Adding full bibliography for 7248888--7248889.cif.	7248889.cif
292469	2024-06-20	cif/ Adding structures of 7248888, 7248889 via cif-deposit CGI script.	7248889.cif