Crystallography Open Database

Information card for entry 4342700

Preview

Coordinates	4342700.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C41 H45 Au2 Cl4 F2 N11 O3 S2
Calculated formula	C41 H42 Au2 Cl4 F2 N11 O3 S2
Title of publication	Synthesis, reactivity, and biological activity of gold(i) complexes modified with thiourea-functionalized tyrosine kinase inhibitors.
Authors of publication	Yang, Mu; Pickard, Amanda J.; Qiao, Xin; Gueble, Matthew J.; Day, Cynthia S.; Kucera, Gregory L.; Bierbach, Ulrich
Journal of publication	Inorganic chemistry
Year of publication	2015
Journal volume	54
Journal issue	7
Pages of publication	3316 - 3324
a	14.4975 ± 0.0011 Å
b	29.057 ± 0.002 Å
c	13.1779 ± 0.001 Å
α	90°
β	118.446 ± 0.001°
γ	90°
Cell volume	4881 ± 0.6 Å³
Cell temperature	193 ± 2 K
Ambient diffraction temperature	193 ± 2 K
Number of distinct elements	8
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0518
Residual factor for significantly intense reflections	0.0334
Weighted residual factors for significantly intense reflections	0.0834
Weighted residual factors for all reflections included in the refinement	0.0905
Goodness-of-fit parameter for all reflections included in the refinement	0.939
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179530 (current)	2016-03-24	cif/4/34/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/34/27.	4342700.cif
138087	2015-06-05	cif/ Updating files of 4342699, 4342700 Original log message: Adding full bibliography for 4342699--4342700.cif.	4342700.cif
134212	2015-03-21	cif/ Adding structures of 4342699, 4342700 via cif-deposit CGI script.	4342700.cif