Crystallography Open Database

Information card for entry 4132600

Preview

Coordinates	4132600.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C70.77 H59.54 N2 O15 Yb2
Calculated formula	C70.78 H59.56 N2 O15 Yb2
Title of publication	On-Demand Degradation of Metal-Organic Framework Based on Photocleavable Dianthracene-Based Ligand.
Authors of publication	Collet, Guillaume; Lathion, Timothée; Besnard, Céline; Piguet, Claude; Petoud, Stéphane
Journal of publication	Journal of the American Chemical Society
Year of publication	2018
Journal volume	140
Journal issue	34
Pages of publication	10820 - 10828
a	16.6368 ± 0.0005 Å
b	18.0871 ± 0.0006 Å
c	19.3244 ± 0.0007 Å
α	84.612 ± 0.003°
β	80.119 ± 0.003°
γ	64.846 ± 0.003°
Cell volume	5184 ± 0.3 Å³
Cell temperature	180 ± 2 K
Ambient diffraction temperature	180.15 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0735
Residual factor for significantly intense reflections	0.059
Weighted residual factors for significantly intense reflections	0.1611
Weighted residual factors for all reflections included in the refinement	0.1744
Goodness-of-fit parameter for all reflections included in the refinement	0.964
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
288248 (current)	2023-12-12	cif/ Removed the misspelt '_symmetry_space_group_name_h-m_alt' data name since the same space group information is already provided using proper data names.	4132600.cif
242547	2019-11-26	cif/ Adding structures of 4132600 via cif-deposit CGI script.	4132600.cif