Crystallography Open Database

Information card for entry 7060408

Preview

Coordinates	7060408.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H39 Gd2 N9 Ni O18
Calculated formula	C30 H39 Gd2 N9 Ni O18
Title of publication	Enhancement of the coordinating flexibility in a Schiff‒Mannich combo ligand: forced generation of a new NiII‒Ophenoxo‒LnIII‒Oalkoxo‒LnIII array (Ln = Gd, Tb, Dy and Ho)
Authors of publication	Bag, Riya; Sikdar, Yeasin; Saha, Pinaki; Ghosh, Prasanta; Drew, Michael G. B.; Tang, Jinkui; Goswami, Sanchita
Journal of publication	New Journal of Chemistry
Year of publication	2021
Journal volume	45
Journal issue	11
Pages of publication	5258 - 5265
a	12.8995 ± 0.0007 Å
b	18.7091 ± 0.001 Å
c	18.0277 ± 0.001 Å
α	90°
β	109.147 ± 0.002°
γ	90°
Cell volume	4110.1 ± 0.4 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0475
Residual factor for significantly intense reflections	0.0372
Weighted residual factors for significantly intense reflections	0.0757
Weighted residual factors for all reflections included in the refinement	0.0834
Goodness-of-fit parameter for all reflections included in the refinement	1.176
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
263808 (current)	2021-04-05	cif/ Updating files of 7060408, 7060409, 7060410, 7060411, 7060412 Original log message: Adding full bibliography for 7060408--7060412.cif.	7060408.cif
261990	2021-02-16	cif/ Adding structures of 7060408, 7060409, 7060410, 7060411, 7060412 via cif-deposit CGI script.	7060408.cif