Crystallography Open Database

Information card for entry 7039826

Preview

Coordinates	7039826.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H46 Au2 Br Cl N8 O3
Calculated formula	C36 H40 Au2 Br Cl N8 O3
Title of publication	Dinuclear Au(i) N-heterocyclic carbene complexes derived from unsymmetrical azolium cyclophane salts: potential probes for live cell imaging applications.
Authors of publication	Wedlock, Louise E.; Barnard, Peter J.; Filipovska, Aleksandra; Skelton, Brian W.; Berners-Price, Susan J; Baker, Murray V.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2016
Journal volume	45
Journal issue	30
Pages of publication	12221 - 12236
a	14.5133 ± 0.0005 Å
b	7.1167 ± 0.0002 Å
c	19.1502 ± 0.0005 Å
α	90°
β	90°
γ	90°
Cell volume	1977.96 ± 0.1 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	7
Space group number	26
Hermann-Mauguin space group symbol	P m c 21
Hall space group symbol	P 2c -2
Residual factor for all reflections	0.0975
Residual factor for significantly intense reflections	0.0603
Weighted residual factors for significantly intense reflections	0.1367
Weighted residual factors for all reflections included in the refinement	0.1462
Goodness-of-fit parameter for all reflections included in the refinement	1.008
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
185328 (current)	2016-08-07	cif/ Updating files of 7039821, 7039822, 7039823, 7039824, 7039825, 7039826, 7039827, 7039828, 7039829, 7039830 Original log message: Adding full bibliography for 7039821--7039830.cif.	7039826.cif
184274	2016-07-07	cif/ Adding structures of 7039821, 7039822, 7039823, 7039824, 7039825, 7039826, 7039827, 7039828, 7039829, 7039830 via cif-deposit CGI script.	7039826.cif