Crystallography Open Database

Information card for entry 7132124

Preview

Coordinates	7132124.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C35 H57 Au B10 N2 O2
Calculated formula	C35 H57 Au B10 N2 O2
Title of publication	Highly phosphorescent Carbene-Metal-Carboranyl complexes of Copper(I) and Gold(I)
Authors of publication	Powley, Samuel L.; Riley, Charlotte; Cho, Hwan-Hee; Phuoc, Nguyen Le; Greenham, N. C.; Linnolahti, Mikko; Romanov, Alexander S.
Journal of publication	Chemical Communications
Year of publication	2023
a	11.48602 ± 0.00012 Å
b	19.7064 ± 0.0002 Å
c	17.35568 ± 0.00019 Å
α	90°
β	93.0324 ± 0.001°
γ	90°
Cell volume	3922.92 ± 0.07 Å³
Cell temperature	100 ± 0.13 K
Ambient diffraction temperature	100 ± 0.13 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0244
Residual factor for significantly intense reflections	0.023
Weighted residual factors for significantly intense reflections	0.0625
Weighted residual factors for all reflections included in the refinement	0.0635
Goodness-of-fit parameter for all reflections included in the refinement	1.134
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7132124.html