Crystallography Open Database

Information card for entry 4335930

Preview

Coordinates	4335930.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C143 H182 B4 N4 Nd4 O33
Calculated formula	C143 H158 B4 N4 Nd4 O33
Title of publication	Porous and Robust Lanthanide Metal-Organoboron Frameworks as Water Tolerant Lewis Acid Catalysts
Authors of publication	Yan Liu; Ke Mo; Yong Cui
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	10286 - 10291
a	37.614 ± 0.0015 Å
b	27.286 ± 0.0011 Å
c	18.2151 ± 0.0007 Å
α	90°
β	90°
γ	90°
Cell volume	18694.8 ± 1.3 Å³
Cell temperature	123 K
Ambient diffraction temperature	123 K
Number of distinct elements	6
Space group number	52
Hermann-Mauguin space group symbol	P n n a
Hall space group symbol	-P 2a 2bc
Residual factor for all reflections	0.1147
Residual factor for significantly intense reflections	0.0832
Weighted residual factors for significantly intense reflections	0.1812
Weighted residual factors for all reflections included in the refinement	0.1949
Goodness-of-fit parameter for all reflections included in the refinement	1.012
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179462 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/59.	4335930.cif
101898	2014-02-19	cif/ Adding structures of 4335930 via cif-deposit CGI script.	4335930.cif