Crystallography Open Database

Information card for entry 4075580

Preview

Coordinates	4075580.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H38 B10 Ir2 O2 Se2
Calculated formula	C20 H38 B10 Ir2 O2 Se2
Title of publication	Formation of Cup-Shaped Metallic Clusters via B−H Activation at the B(3)/B(6) Site of anortho-Carborane-1,2-dichalcogenolato Ligand
Authors of publication	Wang, Jian-Qiang; Herberhold, Max; Jin, Guo-Xin
Journal of publication	Organometallics
Year of publication	2006
Journal volume	25
Journal issue	14
Pages of publication	3508
a	18.289 ± 0.008 Å
b	12.197 ± 0.005 Å
c	12.852 ± 0.006 Å
α	90°
β	107.713 ± 0.006°
γ	90°
Cell volume	2731 ± 2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/c 1
Hall space group symbol	-P 2yc
Residual factor for all reflections	0.0673
Residual factor for significantly intense reflections	0.0513
Weighted residual factors for significantly intense reflections	0.1321
Weighted residual factors for all reflections included in the refinement	0.1388
Goodness-of-fit parameter for all reflections included in the refinement	1.149
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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