Crystallography Open Database

Information card for entry 7230977

Preview

Coordinates	7230977.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H28 Dy2 O16 P2
Calculated formula	C42 H28 Dy2 O16 P2
Title of publication	Two lanthanide metal‒organic frameworks constructed from tris(4-carboxyphenyl)phosphane oxide with gas adsorption and magnetic properties
Authors of publication	Hu, Tuoping; Zhao, Qiannan; Huo, Liangqin; Gao, Lingling; Zhang, Jie; Wang, Xiaoqing; Fan, Liming
Journal of publication	CrystEngComm
Year of publication	2018
Journal volume	20
Journal issue	30
Pages of publication	4291
a	10.4402 ± 0.0006 Å
b	14.6618 ± 0.0008 Å
c	23.087 ± 0.0013 Å
α	72.521 ± 0.002°
β	88.719 ± 0.002°
γ	87.591 ± 0.002°
Cell volume	3367.6 ± 0.3 Å³
Cell temperature	296.15 K
Ambient diffraction temperature	296.15 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0642
Residual factor for significantly intense reflections	0.06
Weighted residual factors for significantly intense reflections	0.1437
Weighted residual factors for all reflections included in the refinement	0.1461
Goodness-of-fit parameter for all reflections included in the refinement	1.117
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
229081 (current)	2019-11-17	cif/ Updating files of 7230976, 7230977 Original log message: Adding full bibliography for 7230976--7230977.cif.	7230977.cif
208575	2018-06-21	cif/ Adding structures of 7230976, 7230977 via cif-deposit CGI script.	7230977.cif