Crystallography Open Database

Information card for entry 7245147

Preview

Coordinates	7245147.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C44 H102 Mo12 N2 Nd O68 P9
Calculated formula	C44 H102 Mo12 N2 Nd O68 P9
Title of publication	Photocatalysis, terahertz time domain spectroscopy and weak interactions of six polyoxometalate-based lanthanide phosphine oxide complexes
Authors of publication	Jin, Guan-Yu; Zhang, Lan; Hu, Fu-Zhen; Hu, Cong; Lu, Yan-Lei; Li, Ying-Yu; Han, Hong-Liang; Liu, Jian-Ming; Yang, Yu-Ping; Jin, Qiong-Hua; Li, Xing-Ru
Journal of publication	CrystEngComm
Year of publication	2022
a	13.7635 ± 0.0011 Å
b	14.7371 ± 0.0012 Å
c	27.829 ± 0.003 Å
α	100.615 ± 0.003°
β	95.236 ± 0.002°
γ	114.371 ± 0.004°
Cell volume	4964.7 ± 0.8 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1785
Residual factor for significantly intense reflections	0.0925
Weighted residual factors for significantly intense reflections	0.2049
Weighted residual factors for all reflections included in the refinement	0.231
Goodness-of-fit parameter for all reflections included in the refinement	1.238
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
276711 (current)	2022-07-07	cif/ Adding structures of 7245142, 7245143, 7245144, 7245145, 7245146, 7245147 via cif-deposit CGI script.	7245147.cif