Crystallography Open Database

Information card for entry 4501761

Preview

Coordinates	4501761.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H8 Cd O8
Calculated formula	C16 H8 Cd O8
Title of publication	Efficient Detection of Organophosphate Pesticide Based on a Metal−Organic Framework Derived from Biphenyltetracarboxylic Acid
Authors of publication	Wen, Li-Li; Wang, Feng; Leng, Xiao-Ke; Wang, Cheng-Gang; Wang, Lian-Yi; Gong, Jing-Ming; Li, Dong-Feng
Journal of publication	Crystal Growth & Design
Year of publication	2010
Journal volume	10
Journal issue	7
Pages of publication	2835
a	15.9934 ± 0.0012 Å
b	9.1122 ± 0.0007 Å
c	9.9053 ± 0.0008 Å
α	90°
β	90°
γ	90°
Cell volume	1443.55 ± 0.19 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	60
Hermann-Mauguin space group symbol	P b c n
Hall space group symbol	-P 2n 2ab
Residual factor for all reflections	0.0283
Residual factor for significantly intense reflections	0.0205
Weighted residual factors for significantly intense reflections	0.0522
Weighted residual factors for all reflections included in the refinement	0.0563
Goodness-of-fit parameter for all reflections included in the refinement	1.044
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
179548 (current)	2016-03-24	cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/17.	4501761.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4501761.cif
36091	2012-03-01	../uploads/cif-deposit/cod/cif Adding structures of 4501761 via cif-deposit CGI script.	4501761.cif