Crystallography Open Database

Information card for entry 7716980

Preview

Coordinates	7716980.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	GdF4BDC
Formula	C15 H8 F6 Gd N O8
Calculated formula	C15 H8 F6 Gd N O8
Title of publication	Relaxometric Properties and Biocompatibility of a Novel Nanostructured Fluorinated Gadolinium Metal-Organic Framework
Authors of publication	Trovarelli, Letizia; Mirarchi, Alessandra; Arcuri, Cataldo; Bruscoli, Stefano; Bereshchenko, Oxana; Febo, Marta; Costantino, Ferdinando; Carniato, Fabio
Journal of publication	Dalton Transactions
Year of publication	2024
a	7.7894 ± 0.0002 Å
b	21.8151 ± 0.0006 Å
c	10.1789 ± 0.0003 Å
α	90°
β	98.8 ± 0.001°
γ	90°
Cell volume	1709.3 ± 0.08 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/a 1
Hall space group symbol	-P 2yab
Residual factor for all reflections	0.0298
Residual factor for significantly intense reflections	0.0247
Weighted residual factors for significantly intense reflections	0.0549
Weighted residual factors for all reflections included in the refinement	0.0577
Goodness-of-fit parameter for all reflections included in the refinement	1.111
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7716980.html