Crystallography Open Database

Information card for entry 1549201

Preview

Coordinates	1549201.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C26 H19 Au Cl F12 N3 O P2
Calculated formula	C26 H19 Au Cl F12 N3 O P2
SMILES	[Au]12(Cl)[n]3ccccc3c3cc(cc([n]13)c1[n]2cccc1)c1ccc(OC)c2ccccc12.[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-]
Title of publication	Spectroscopy, electrochemistry and antiproliferative properties of Au(iii), Pt(ii) and Cu(ii) complexes bearing modified 2,2':6',2''-terpyridine ligands.
Authors of publication	Maroń, Anna; Czerwińska, Katarzyna; Machura, Barbara; Raposo, Luis; Roma-Rodrigues, Catarina; Fernandes, Alexandra R.; Małecki, Jan G; Szlapa-Kula, Agata; Kula, Slawomir; Krompiec, Stanisław
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2018
Journal volume	47
Journal issue	18
Pages of publication	6444 - 6463
a	8.075 ± 0.0003 Å
b	21.7655 ± 0.0009 Å
c	17.4149 ± 0.0006 Å
α	90°
β	93.847 ± 0.003°
γ	90°
Cell volume	3053.9 ± 0.2 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	295 ± 2 K
Number of distinct elements	8
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	0.0871
Residual factor for significantly intense reflections	0.0515
Weighted residual factors for significantly intense reflections	0.1091
Weighted residual factors for all reflections included in the refinement	0.1248
Goodness-of-fit parameter for all reflections included in the refinement	1.029
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
229876 (current)	2019-11-17	cif/ Updating files of 1549200, 1549201, 1549202, 1549203 Original log message: Adding full bibliography for 1549200--1549203.cif.	1549201.cif
207234	2018-04-05	cif/ Adding structures of 1549200, 1549201, 1549202, 1549203 via cif-deposit CGI script.	1549201.cif