Crystallography Open Database

Information card for entry 7245917

Preview

Coordinates	7245917.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C15 H38 Cl4 Gd7 N3 O32
Calculated formula	C15 H38 Cl4 Gd7 N3 O32
Title of publication	Two heptanuclear cluster-based 3D metal–organic frameworks with a good magnetocaloric effect
Authors of publication	Cao, Shouying; Fan, Chenpeng; Lu, Mengwen; Li, Meng; Zhou, Yuhang; Wang, Hongxia; Lin, Qingfang; Liang, Lili
Journal of publication	CrystEngComm
Year of publication	2023
Journal volume	25
Journal issue	2
Pages of publication	309 - 313
a	12.1692 ± 0.0005 Å
b	12.1692 ± 0.0005 Å
c	18.022 ± 0.0011 Å
α	90°
β	90°
γ	120°
Cell volume	2311.31 ± 0.19 Å³
Cell temperature	170 ± 2 K
Ambient diffraction temperature	170 K
Number of distinct elements	6
Space group number	176
Hermann-Mauguin space group symbol	P 63/m
Hall space group symbol	-P 6c
Residual factor for all reflections	0.0415
Residual factor for significantly intense reflections	0.0327
Weighted residual factors for significantly intense reflections	0.0746
Weighted residual factors for all reflections included in the refinement	0.0798
Goodness-of-fit parameter for all reflections included in the refinement	1.073
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
281442 (current)	2023-03-04	cif/ Updating files of 7245917, 7245918 Original log message: Adding full bibliography for 7245917--7245918.cif.	7245917.cif
279573	2022-11-26	cif/ Adding structures of 7245917, 7245918 via cif-deposit CGI script.	7245917.cif