Crystallography Open Database

Information card for entry 7241989

7241988 << 7241989 >> 7241990

Preview

Coordinates	7241989.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C21 H16 N Nd O7.5
Calculated formula	C21 H16 N Nd O7.5
Title of publication	Structural diversity of four lanthanide metal‒organic frameworks based on 2,6-naphthalenedicarboxylate: synthesis, structures and photoluminescent properties
Authors of publication	Chatenever, Ana R. K.; Ehlke, Beatriz; Le Maguerès, Pierre; Reinheimer, Eric W.; Song, Xueling; Fei, Honghan; Oliver, Scott R. J.
Journal of publication	CrystEngComm
Year of publication	2021
Journal volume	23
Journal issue	6
Pages of publication	1388 - 1397
a	12.4204 ± 0.0005 Å
b	21.5953 ± 0.0007 Å
c	16.3081 ± 0.0006 Å
α	90°
β	102.907 ± 0.004°
γ	90°
Cell volume	4263.7 ± 0.3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0288
Residual factor for significantly intense reflections	0.0254
Weighted residual factors for significantly intense reflections	0.0675
Weighted residual factors for all reflections included in the refinement	0.0688
Goodness-of-fit parameter for all reflections included in the refinement	1.075
Diffraction radiation probe	x-ray
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
262580 (current)	2021-03-05	cif/ Updating files of 7241989, 7241990, 7241991, 7241992 Original log message: Adding full bibliography for 7241989--7241992.cif.	7241989.cif
260218	2020-12-30	cif/ Adding structures of 7241989, 7241990, 7241991, 7241992 via cif-deposit CGI script.	7241989.cif