Crystallography Open Database

Information card for entry 7716842

Preview

Coordinates	7716842.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C29.2 H32.8 Au N3 O1.2 S2
Calculated formula	C28 H28 Au N3 S2
Title of publication	Exploring antiviral and antiparasitic activity of gold N-heterocyclic carbenes with thiolate ligands.
Authors of publication	Oliveira, Igor S.; Garcia, Marcus S. A.; Cassani, Natasha M.; Oliveira, Ana L. C.; Freitas, Lara C. F.; Bertolini, Vitor K. S.; Castro, Jennyfer; Clauss, Gustavo; Honorato, João; Gadelha, Fernanda R.; Miguel, Danilo C.; Jardim, Ana C. G.; Abbehausen, Camilla
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2024
Journal volume	53
Journal issue	47
Pages of publication	18963 - 18973
a	11.1702 ± 0.0012 Å
b	15.1601 ± 0.0017 Å
c	17.1723 ± 0.0019 Å
α	86.211 ± 0.003°
β	76.397 ± 0.002°
γ	81.795 ± 0.003°
Cell volume	2795.9 ± 0.5 Å³
Cell temperature	120 K
Ambient diffraction temperature	120 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0306
Residual factor for significantly intense reflections	0.0207
Weighted residual factors for significantly intense reflections	0.0393
Weighted residual factors for all reflections included in the refinement	0.0417
Goodness-of-fit parameter for all reflections included in the refinement	1.0041
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
296573 (current)	2024-12-06	cif/ Updating files of 7716840, 7716841, 7716842, 7716843 Original log message: Adding full bibliography for 7716840--7716843.cif.	7716842.cif
294140	2024-08-16	cif/ Adding structures of 7716840, 7716841, 7716842, 7716843 via cif-deposit CGI script.	7716842.cif