Crystallography Open Database

Information card for entry 7716840

Preview

Coordinates	7716840.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C25 H27 Au N4 O S
Calculated formula	C25 H27 Au N4 O S
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	9.0579 ± 0.0001 Å
b	21.2344 ± 0.0003 Å
c	25.5964 ± 0.0004 Å
α	90°
β	96.504 ± 0.001°
γ	90°
Cell volume	4891.5 ± 0.12 Å³
Cell temperature	100.01 ± 0.1 K
Ambient diffraction temperature	100.15 K
Number of distinct elements	6
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	0.0252
Residual factor for significantly intense reflections	0.0193
Weighted residual factors for significantly intense reflections	0.0355
Weighted residual factors for all reflections included in the refinement	0.0365
Goodness-of-fit parameter for all reflections included in the refinement	1.0301
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.	7716840.cif
294140	2024-08-16	cif/ Adding structures of 7716840, 7716841, 7716842, 7716843 via cif-deposit CGI script.	7716840.cif