Crystallography Open Database

Information card for entry 7047525

Preview

Coordinates	7047525.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H14.41 Dy N2 O11.7
Calculated formula	C16 H14.4 Dy N2 O11.7
Title of publication	Implementation of slow magnetic relaxation in a SIM-MOF through a structural rearrangement.
Authors of publication	Castells-Gil, Javier; Baldoví, José J; Martí-Gastaldo, Carlos; Mínguez Espallargas, Guillermo
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2018
Journal volume	47
Journal issue	41
Pages of publication	14734 - 14740
a	6.6676 ± 0.0003 Å
b	10.1303 ± 0.0005 Å
c	13.8039 ± 0.0006 Å
α	74.983 ± 0.004°
β	78.546 ± 0.004°
γ	83.143 ± 0.004°
Cell volume	880.33 ± 0.07 Å³
Cell temperature	120 ± 0.1 K
Ambient diffraction temperature	120 ± 0.1 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.029
Residual factor for significantly intense reflections	0.0262
Weighted residual factors for significantly intense reflections	0.0557
Weighted residual factors for all reflections included in the refinement	0.0573
Goodness-of-fit parameter for all reflections included in the refinement	1.071
Diffraction radiation probe	x-ray
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
229340 (current)	2019-11-17	cif/ Updating files of 7047525, 7047526 Original log message: Adding full bibliography for 7047525--7047526.cif.	7047525.cif
210912	2018-09-13	cif/ Adding structures of 7047525, 7047526 via cif-deposit CGI script.	7047525.cif