Crystallography Open Database

Information card for entry 7049015

Preview

Coordinates	7049015.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C21 H36 Cl3 N2 Ni O10 Y
Calculated formula	C21 H36 Cl3 N2 Ni O10 Y
Title of publication	Influence of ancillary ligands and solvents on the nuclearity of Ni-Ln complexes.
Authors of publication	Costes, Jean-Pierre; Mallet-Ladeira, Sonia; Vendier, Laure; Maurice, Rémi; Wernsdorfer, Wolfgang
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	10
Pages of publication	3404 - 3414
a	8.8025 ± 0.0002 Å
b	16.3713 ± 0.0004 Å
c	20.1951 ± 0.0005 Å
α	90°
β	90°
γ	90°
Cell volume	2910.28 ± 0.12 Å³
Cell temperature	180 ± 2 K
Ambient diffraction temperature	180 ± 2 K
Number of distinct elements	7
Space group number	29
Hermann-Mauguin space group symbol	P c a 21
Hall space group symbol	P 2c -2ac
Residual factor for all reflections	0.024
Residual factor for significantly intense reflections	0.0199
Weighted residual factors for significantly intense reflections	0.0377
Weighted residual factors for all reflections included in the refinement	0.038
Goodness-of-fit parameter for all reflections included in the refinement	0.978
Diffraction radiation probe	x-ray
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
223813 (current)	2019-11-07	cif/ Updating files of 7049013, 7049014, 7049015, 7049016 Original log message: Adding full bibliography for 7049013--7049016.cif.	7049015.cif
213634	2019-02-14	cif/ Adding structures of 7049013, 7049014, 7049015, 7049016 via cif-deposit CGI script.	7049015.cif