Crystallography Open Database

Information card for entry 7706680

Preview

Coordinates	7706680.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C70 H54 N31 O21 Tb3
Calculated formula	C70 H54 N31 O21 Tb3
Title of publication	Lanthanide clusters of phenanthroline containing a pyridine-pyrazole based ligand: magnetism and cell imaging.
Authors of publication	De, Avik; Bala, Sukhen; Saha, Sayan; Das, Krishna Sundar; Akhtar, Sohel; Adhikary, Amit; Ghosh, Arijit; Huang, Guo-Zhang; Chowdhuri, Srijita Paul; Das, Benu Brata; Tong, Ming-Liang; Mondal, Raju
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2021
Journal volume	50
Journal issue	10
Pages of publication	3593 - 3609
a	32.353 ± 0.005 Å
b	35.316 ± 0.006 Å
c	13.8018 ± 0.0019 Å
α	90°
β	90°
γ	90°
Cell volume	15770 ± 4 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	5
Space group number	43
Hermann-Mauguin space group symbol	F d d 2
Hall space group symbol	F 2 -2d
Residual factor for all reflections	0.0841
Residual factor for significantly intense reflections	0.068
Weighted residual factors for significantly intense reflections	0.1633
Weighted residual factors for all reflections included in the refinement	0.1773
Goodness-of-fit parameter for all reflections included in the refinement	1.105
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
263742 (current)	2021-04-05	cif/ Updating files of 7706680, 7706681, 7706682 Original log message: Adding full bibliography for 7706680--7706682.cif.	7706680.cif
262246	2021-02-26	cif/ Adding structures of 7706680, 7706681, 7706682 via cif-deposit CGI script.	7706680.cif