Crystallography Open Database

Information card for entry 7241458

Preview

Coordinates	7241458.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H32 O25 Sm2
Calculated formula	C24 H8 O25 Sm2
Title of publication	Lanthanide-based molecular alloys with hydroxyterephthalate: a versatile system
Authors of publication	Wang, Jinzeng; Suffren, Yan; Daiguebonne, Carole; Bernot, Kevin; Calvez, Guillaume; Freslon, Stéphane; Guillou, Olivier
Journal of publication	CrystEngComm
Year of publication	2021
Journal volume	23
Journal issue	1
Pages of publication	100 - 118
a	7.9806 ± 0.0008 Å
b	9.954 ± 0.0009 Å
c	10.8426 ± 0.0011 Å
α	74.62 ± 0.003°
β	74.092 ± 0.003°
γ	73.803 ± 0.003°
Cell volume	778.67 ± 0.13 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0242
Residual factor for significantly intense reflections	0.0232
Weighted residual factors for significantly intense reflections	0.0605
Weighted residual factors for all reflections included in the refinement	0.0608
Goodness-of-fit parameter for all reflections included in the refinement	1.136
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
261588 (current)	2021-02-05	cif/ Updating files of 7241457, 7241458, 7241459, 7241460, 7241461, 7241462 Original log message: Adding full bibliography for 7241457--7241462.cif.	7241458.cif
259290	2020-11-29	cif/ Adding structures of 7241457, 7241458, 7241459, 7241460, 7241461, 7241462 via cif-deposit CGI script.	7241458.cif