Crystallography Open Database

Information card for entry 7709419

Preview

Coordinates	7709419.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C45.69 H37.91 Au2 Br1.22 O P2 S0.78
Calculated formula	C45.692 H37.91 Au2 Br1.218 O P2 S0.782
Title of publication	Hetero- and homoleptic binuclear gold(I)-thiolate and -halide complexes - ligand exchange kinetics and supramolecular structures.
Authors of publication	Ang, Pau Lin; Nguyen, Van Ha; Yip, John H. K.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2022
Journal volume	51
Journal issue	8
Pages of publication	3081 - 3095
a	10.3902 ± 0.0004 Å
b	19.1329 ± 0.0007 Å
c	21.1022 ± 0.0009 Å
α	90°
β	92.242 ± 0.002°
γ	90°
Cell volume	4191.8 ± 0.3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 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	0.0465
Residual factor for significantly intense reflections	0.0334
Weighted residual factors for significantly intense reflections	0.0763
Weighted residual factors for all reflections included in the refinement	0.0811
Goodness-of-fit parameter for all reflections included in the refinement	1.011
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
273368 (current)	2022-03-05	cif/ Updating files of 7709417, 7709418, 7709419, 7709420 Original log message: Adding full bibliography for 7709417--7709420.cif.	7709419.cif
272511	2022-02-04	cif/ Adding structures of 7709417, 7709418, 7709419, 7709420 via cif-deposit CGI script.	7709419.cif