Crystallography Open Database

Information card for entry 1516319

Preview

Coordinates	1516319.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C25 H16 N4 O4
Calculated formula	C25 H16 N4 O4
Title of publication	Constructing monocrystalline covalent organic networks by polymerization
Authors of publication	Beaudoin, Daniel; Maris, Thierry; Wuest, James D.
Journal of publication	Nature Chemistry
Year of publication	2013
Journal volume	5
Pages of publication	830 - 834
a	13.1545 ± 0.0015 Å
b	13.1545 ± 0.0015 Å
c	7.9818 ± 0.0009 Å
α	90°
β	90°
γ	90°
Cell volume	1381.2 ± 0.3 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	4
Space group number	117
Hermann-Mauguin space group symbol	P -4 b 2
Hall space group symbol	P -4 -2ab
Residual factor for all reflections	0.0892
Residual factor for significantly intense reflections	0.0807
Weighted residual factors for significantly intense reflections	0.2344
Weighted residual factors for all reflections included in the refinement	0.2417
Goodness-of-fit parameter for all reflections included in the refinement	1.12
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
176729 (current)	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1.	1516319.cif
120071	2014-07-11	Adding DOIs to range 1 structures.	1516319.cif
114554	2014-05-26	cif/ Adding structures of 1516319 via cif-deposit CGI script.	1516319.cif