Crystallography Open Database

Information card for entry 1572643

Preview

Coordinates	1572643.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C31.32 H43.3 Au O2.33 P
Calculated formula	C31.32 H43.3 Au O2.33 P
Title of publication	Catechol/<i>o</i>-benzoquinone exchange at gold(iii).
Authors of publication	León, Félix; García-Rodeja, Yago; Mallet-Ladeira, Sonia; Miqueu, Karinne; Szalóki, György; Bourissou, Didier
Journal of publication	Chemical science
Year of publication	2024
Journal volume	15
Journal issue	40
Pages of publication	16651 - 16659
a	28.7347 ± 0.0009 Å
b	28.7347 ± 0.0009 Å
c	20.9068 ± 0.001 Å
α	90°
β	90°
γ	120°
Cell volume	14949.7 ± 1 Å³
Cell temperature	193 ± 2 K
Ambient diffraction temperature	193 ± 2 K
Number of distinct elements	5
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Residual factor for all reflections	0.044
Residual factor for significantly intense reflections	0.0294
Weighted residual factors for significantly intense reflections	0.0682
Weighted residual factors for all reflections included in the refinement	0.0766
Goodness-of-fit parameter for all reflections included in the refinement	1.068
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
296427 (current)	2024-12-06	cif/ Updating files of 1572639, 1572640, 1572641, 1572642, 1572643, 1572644, 1572645 Original log message: Adding full bibliography for 1572639--1572645.cif.	1572643.cif
294831	2024-09-21	cif/ Adding structures of 1572639, 1572640, 1572641, 1572642, 1572643, 1572644, 1572645 via cif-deposit CGI script.	1572643.cif