Crystallography Open Database

Information card for entry 4129323

Preview

Coordinates	4129323.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C270 H209 F6 N11 O187.5 Y27
Calculated formula	C269.998 H208.994 F6 N10.9992 O187.499 Y27
Title of publication	Quest for highly connected metal-organic framework platforms: rare-earth polynuclear clusters versatility meets net topology needs.
Authors of publication	Alezi, Dalal; Peedikakkal, Abdul Malik P.; Weseliński, Łukasz J; Guillerm, Vincent; Belmabkhout, Youssef; Cairns, Amy J.; Chen, Zhijie; Wojtas, Łukasz; Eddaoudi, Mohamed
Journal of publication	Journal of the American Chemical Society
Year of publication	2015
Journal volume	137
Journal issue	16
Pages of publication	5421 - 5430
a	26.1763 ± 0.0009 Å
b	26.1763 ± 0.0009 Å
c	26.3956 ± 0.0011 Å
α	90°
β	90°
γ	120°
Cell volume	15663.1 ± 1 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100.15 K
Number of distinct elements	6
Space group number	191
Hermann-Mauguin space group symbol	P 6/m m m
Hall space group symbol	-P 6 2
Residual factor for all reflections	0.0711
Residual factor for significantly intense reflections	0.0681
Weighted residual factors for significantly intense reflections	0.2147
Weighted residual factors for all reflections included in the refinement	0.2183
Goodness-of-fit parameter for all reflections included in the refinement	1.144
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
240058 (current)	2019-11-25	cif/ Adding structures of 4129323 via cif-deposit CGI script.	4129323.cif