Crystallography Open Database

Information card for entry 7239719

Preview

Coordinates	7239719.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H32 Gd12 N16 O64
Calculated formula	C48 H32 Gd12 N16 O64
Title of publication	Manipulating clusters by regulating N,O chelating ligands: structures and multistep assembly mechanisms
Authors of publication	Wang, Hai-Ling; Liu, Zi-Yuan; Zhu, Zhong-Hong; Peng, Jin-Mei; Ma, Xiong-Feng; Bai, Juan; Zou, Hua-Hong; Mo, Kai-Qiang; Liang, Fu-Pei
Journal of publication	CrystEngComm
Year of publication	2020
Journal volume	22
Journal issue	5
Pages of publication	915 - 923
a	18.4916 ± 0.0016 Å
b	18.4916 ± 0.0016 Å
c	21.4412 ± 0.0019 Å
α	90°
β	90°
γ	90°
Cell volume	7331.6 ± 1.1 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296.15 K
Number of distinct elements	5
Space group number	97
Hermann-Mauguin space group symbol	I 4 2 2
Hall space group symbol	I 4 2
Residual factor for all reflections	0.0564
Residual factor for significantly intense reflections	0.0506
Weighted residual factors for significantly intense reflections	0.1429
Weighted residual factors for all reflections included in the refinement	0.1467
Goodness-of-fit parameter for all reflections included in the refinement	1.038
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
257449 (current)	2020-10-06	cif/ Updating files of 7239717, 7239718, 7239719 Original log message: Adding full bibliography for 7239717--7239719.cif.	7239719.cif
247661	2020-02-04	cif/ Updating files of 7239717, 7239718, 7239719 Original log message: Adding full bibliography for 7239717--7239719.cif.	7239719.cif
246456	2020-01-03	cif/ Adding structures of 7239717, 7239718, 7239719 via cif-deposit CGI script.	7239719.cif