Crystallography Open Database

Information card for entry 4308665

Preview

Coordinates	4308665.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H35 Ge4 Ir3 O6
Calculated formula	C48 H35 Ge4 Ir3 O6
SMILES	[Ir]1234([Ir]56([Ir]1([Ge]5(c1ccccc1)c1ccccc1)([Ge]3(c1ccccc1)c1ccccc1)([Ge]46c1ccccc1)(C#[O])C#[O])([Ge]2(c1ccccc1)c1ccccc1)(C#[O])C#[O])(C#[O])C#[O]
Title of publication	High-Nuclearity Iridium Carbonyl Clusters Containing Phenylgermyl Ligands: Synthesis, Structures, and Reactivity
Authors of publication	Richard D. Adams; Burjor Captain; Jack L. Smith
Journal of publication	Inorganic Chemistry
Year of publication	2005
Journal volume	44
Pages of publication	1413 - 1420
a	11.6076 ± 0.0007 Å
b	12.9334 ± 0.0008 Å
c	17.352 ± 0.0011 Å
α	98.003 ± 0.001°
β	93.926 ± 0.001°
γ	114.303 ± 0.001°
Cell volume	2328.1 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0322
Residual factor for significantly intense reflections	0.028
Weighted residual factors for significantly intense reflections	0.0693
Weighted residual factors for all reflections included in the refinement	0.0718
Goodness-of-fit parameter for all reflections included in the refinement	1.018
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

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