Crystallography Open Database

Information card for entry 4312304

Preview

Coordinates	4312304.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H42.5 Ce Cl N4 O9.25
Calculated formula	C38 H42 Ce Cl N4 O9.25
Title of publication	A Schiff-Base Bibracchial Lariat Ether Forming a Cryptand-like Cavity for Lanthanide Ions
Authors of publication	Marina González-Lorenzo; Carlos Platas-Iglesias; Fernando Avecilla; Carlos F. G. C. Geraldes; Daniel Imbert; Jean-Claude G. Bünzli; Andrés de Blas; Teresa Rodríguez-Blas
Journal of publication	Inorganic Chemistry
Year of publication	2003
Journal volume	42
Pages of publication	6946 - 6954
a	25.5382 ± 0.0004 Å
b	11.6407 ± 0.0002 Å
c	27.6814 ± 0.0006 Å
α	90°
β	110.7°
γ	90°
Cell volume	7698 ± 0.2 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/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.2231
Residual factor for significantly intense reflections	0.0958
Weighted residual factors for significantly intense reflections	0.1443
Weighted residual factors for all reflections included in the refinement	0.1873
Goodness-of-fit parameter for all reflections included in the refinement	1.061
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4312304.html