Crystallography Open Database

Information card for entry 1571120

Preview

Coordinates	1571120.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C202 H222 Cl12 Fe8 Ir8 N8 O
Calculated formula	C202 H222 Cl12 Fe8 Ir8 N8 O
Title of publication	Chlorido-pentamethylcyclopentadienyl-[2-(2-pyridyl-кN)-ferrocenyl-кC]-iridium(III)
Authors of publication	Weigand, Stefan; Sünkel, Karlheinz
Journal of publication	Molbank
Year of publication	2024
Journal volume	2024
Journal issue	1
Pages of publication	M1770
a	30.7102 ± 0.0006 Å
b	18.9149 ± 0.0004 Å
c	15.7234 ± 0.0002 Å
α	90°
β	90.301 ± 0.001°
γ	90°
Cell volume	9133.3 ± 0.3 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	7
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0434
Residual factor for significantly intense reflections	0.0303
Weighted residual factors for significantly intense reflections	0.0734
Weighted residual factors for all reflections included in the refinement	0.0811
Goodness-of-fit parameter for all reflections included in the refinement	1.029
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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