Crystallography Open Database

Information card for entry 4129320

Preview

Coordinates	4129320.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C316 H220 F4 N24 O203.27 Y30.68
Calculated formula	C316.006 H220.001 F3.9984 N24 O207.77 Y30.6766
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	29.3518 ± 0.0016 Å
b	29.3518 ± 0.0016 Å
c	21.1634 ± 0.0016 Å
α	90°
β	90°
γ	120°
Cell volume	15790.1 ± 1.7 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	0.1308
Residual factor for significantly intense reflections	0.0997
Weighted residual factors for significantly intense reflections	0.2859
Weighted residual factors for all reflections included in the refinement	0.3214
Goodness-of-fit parameter for all reflections included in the refinement	1.107
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
240055 (current)	2019-11-25	cif/ Adding structures of 4129320 via cif-deposit CGI script.	4129320.cif