Crystallography Open Database

Information card for entry 7709141

Preview

Coordinates	7709141.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42.5 H49.5 As B Cl9.5 Ir N6 O2 W
Calculated formula	C42.5 H49.5 As B Cl9.5 Ir N6 O2 W
Title of publication	Arsinocarbyne reactivity.
Authors of publication	Frogley, Benjamin J.; Hill, Anthony F.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2022
Journal volume	51
Journal issue	5
Pages of publication	1907 - 1917
a	20.5783 ± 0.0007 Å
b	18.5015 ± 0.0005 Å
c	33.6485 ± 0.0009 Å
α	90°
β	106.977 ± 0.003°
γ	90°
Cell volume	12252.7 ± 0.7 Å³
Cell temperature	150 ± 0.1 K
Ambient diffraction temperature	150 ± 0.1 K
Number of distinct elements	9
Space group number	15
Hermann-Mauguin space group symbol	I 1 2/a 1
Hall space group symbol	-I 2ya
Residual factor for all reflections	0.078
Residual factor for significantly intense reflections	0.0524
Weighted residual factors for significantly intense reflections	0.1232
Weighted residual factors for all reflections included in the refinement	0.1352
Goodness-of-fit parameter for all reflections included in the refinement	0.991
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
272672 (current)	2022-02-04	cif/ Updating files of 7709141, 7709142, 7709143, 7709144, 7709145, 7709146 Original log message: Adding full bibliography for 7709141--7709146.cif.	7709141.cif
271590	2021-12-23	cif/ Adding structures of 7709141, 7709142, 7709143, 7709144, 7709145, 7709146 via cif-deposit CGI script.	7709141.cif