Crystallography Open Database

Information card for entry 7117549

Preview

Coordinates	7117549.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H20 O4 S8
Calculated formula	C40 H20 O4 S8
SMILES	c12c(c(C=O)c3c(c2C=O)sc2c(s3)cccc2)sc2c(s1)cccc2
Title of publication	In situ production of silver nanoparticles on an aldehyde-equipped conjugated porous polymer and subsequent heterogeneous reduction of aromatic nitro groups at room temperature
Authors of publication	Jie Liu; Jieshun Cui; Filipe Vilela; Jun He; Matthias Zeller; Allen D. Hunter; Zhengtao Xu
Journal of publication	Chem.Commun.
Year of publication	2015
Journal volume	51
Pages of publication	12197
a	3.9761 ± 0.0002 Å
b	20.6573 ± 0.0011 Å
c	9.8948 ± 0.0006 Å
α	90°
β	96.5712 ± 0.0018°
γ	90°
Cell volume	807.38 ± 0.08 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0399
Residual factor for significantly intense reflections	0.0341
Weighted residual factors for significantly intense reflections	0.0827
Weighted residual factors for all reflections included in the refinement	0.0856
Goodness-of-fit parameter for all reflections included in the refinement	1.093
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
152131 (current)	2015-07-16	cif/ Adding structures of 7117549 via cif-deposit CGI script.	7117549.cif