Crystallography Open Database

Information card for entry 1570952

Preview

Coordinates	1570952.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	Eu-NH2-BDC-100K
Formula	C96 Eu12 N12 O64
Calculated formula	C96 Eu12 N12 O64
Title of publication	Regulating luminescence thermal enhancement in negative thermal expansion metal-organic frameworks.
Authors of publication	Chen, Liang; Cao, Yili; Ma, Rui; Cao, Hongmei; Chen, Xin; Lin, Kun; Li, Qiang; Deng, Jinxia; Liu, Chunyu; Wang, Yilin; Huang, Ling; Xing, Xianran
Journal of publication	Chemical science
Year of publication	2024
Journal volume	15
Journal issue	10
Pages of publication	3721 - 3729
a	21.6551 ± 0.0008 Å
b	21.6551 ± 0.0008 Å
c	21.6551 ± 0.0008 Å
α	90°
β	90°
γ	90°
Cell volume	10155 ± 0.6 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	4
Space group number	225
Hermann-Mauguin space group symbol	F m -3 m
Hall space group symbol	-F 4 2 3
Residual factor for all reflections	0.058
Residual factor for significantly intense reflections	0.0425
Weighted residual factors for significantly intense reflections	0.109
Weighted residual factors for all reflections included in the refinement	0.1182
Goodness-of-fit parameter for all reflections included in the refinement	1.026
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
290836 (current)	2024-04-05	cif/ Updating files of 1570952, 1570953, 1570954, 1570955, 1570956, 1570957, 1570958, 1570959, 1570960, 1570961, 1570962, 1570963, 1570964, 1570965, 1570966 Original log message: Adding full bibliography for 1570952--1570966.cif.	1570952.cif
289741	2024-02-08	cif/ Adding structures of 1570952, 1570953, 1570954, 1570955, 1570956, 1570957, 1570958, 1570959, 1570960, 1570961, 1570962, 1570963, 1570964, 1570965, 1570966 via cif-deposit CGI script.	1570952.cif