Crystallography Open Database

Information card for entry 7110263

Preview

Coordinates	7110263.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C78 H73 Au2 F12 N26 O15 S4
Calculated formula	C78 H73 Au2 F12 N26 O15 S4
Title of publication	Metallamacrocycle-modified gold nanoparticles: a new pathway for surface functionalization
Authors of publication	Hai-Xia Liu; Xin He; Liang Zhao
Journal of publication	Chem.Commun.
Year of publication	2014
Journal volume	50
Pages of publication	971
a	21.3858 ± 0.0009 Å
b	13.9075 ± 0.0007 Å
c	30.0241 ± 0.0013 Å
α	90°
β	102.41 ± 0.003°
γ	90°
Cell volume	8721.2 ± 0.7 Å³
Cell temperature	143 ± 2 K
Ambient diffraction temperature	143 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0831
Residual factor for significantly intense reflections	0.074
Weighted residual factors for significantly intense reflections	0.1923
Weighted residual factors for all reflections included in the refinement	0.2043
Goodness-of-fit parameter for all reflections included in the refinement	1.047
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
180216 (current)	2016-03-26	cif/7/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/11/02.	7110263.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7110263.cif
93865	2014-01-20	cif/ Adding structures of 7110262, 7110263 via cif-deposit CGI script.	7110263.cif