Crystallography Open Database

Information card for entry 7718805

Preview

Coordinates	7718805.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H24 Al Cl6 O6 Sc
Calculated formula	C12 H24 Al Cl6 O6 Sc
Title of publication	Crown-ether coordination compounds of zirconium, hafnium and scandium using metal nanoparticles.
Authors of publication	Faden, Lara-Pauline; Bayarjargal, Lkhamsuren; Milman, Victor; Winkler, Björn; Feldmann, Claus
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2025
Journal volume	54
Journal issue	24
Pages of publication	9670 - 9678
a	19.413 ± 0.009 Å
b	11.237 ± 0.003 Å
c	21.092 ± 0.007 Å
α	90°
β	90°
γ	90°
Cell volume	4601 ± 3 Å³
Cell temperature	150 K
Ambient diffraction temperature	150 K
Number of distinct elements	6
Space group number	33
Hermann-Mauguin space group symbol	P n a 21
Hall space group symbol	P 2c -2n
Residual factor for all reflections	0.0789
Residual factor for significantly intense reflections	0.0417
Weighted residual factors for significantly intense reflections	0.076
Weighted residual factors for all reflections included in the refinement	0.0831
Goodness-of-fit parameter for all reflections included in the refinement	0.837
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
300754 (current)	2025-07-06	cif/ Updating files of 7718804, 7718805, 7718806, 7718807 Original log message: Adding full bibliography for 7718804--7718807.cif.	7718805.cif
299834	2025-05-28	cif/ Adding structures of 7718804, 7718805, 7718806, 7718807 via cif-deposit CGI script.	7718805.cif