Crystallography Open Database

Information card for entry 1567340

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Coordinates	1567340.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H28 Au Cl N2 O
Calculated formula	C18 H28 Au Cl N2 O
Title of publication	Chiral oxazolidines acting as transient hydroxyalkyl-functionalized N-heterocyclic carbenes: an efficient route to air stable copper and gold complexes for asymmetric catalysis
Authors of publication	Pichon-Barré, Delphine; Zhang, Ziyun; Cador, Aël; Vives, Thomas; Roisnel, Thierry; Baslé, Olivier; Jarrige, Lucie; Cavallo, Luigi; Falivene, Laura; Mauduit, Marc
Journal of publication	Chemical Science
Year of publication	2022
a	28.311 ± 0.003 Å
b	9.3672 ± 0.0009 Å
c	15.1782 ± 0.0016 Å
α	90°
β	102.115 ± 0.004°
γ	90°
Cell volume	3935.5 ± 0.7 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	5
Hermann-Mauguin space group symbol	C 1 2 1
Hall space group symbol	C 2y
Residual factor for all reflections	0.0351
Residual factor for significantly intense reflections	0.029
Weighted residual factors for significantly intense reflections	0.0598
Weighted residual factors for all reflections included in the refinement	0.0619
Goodness-of-fit parameter for all reflections included in the refinement	1.024
Diffraction radiation probe	x-ray
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
276810 (current)	2022-07-23	cif/ Adding structures of 1567339, 1567340, 1567341 via cif-deposit CGI script.	1567340.cif