Crystallography Open Database

Information card for entry 7059966

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Coordinates	7059966.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H20 Cl Fe N O
Calculated formula	C24 H20 Cl Fe N O
Title of publication	Iodoferrocene as a partner in N-arylation of amides
Authors of publication	Kadari, Lingaswamy; Erb, William; Roisnel, Thierry; Radha Krishna, Palakodety; Mongin, Florence
Journal of publication	New Journal of Chemistry
Year of publication	2020
Journal volume	44
Journal issue	37
Pages of publication	15928 - 15941
a	10.9882 ± 0.0005 Å
b	12.9018 ± 0.0005 Å
c	14.8228 ± 0.0005 Å
α	99.381 ± 0.002°
β	91.412 ± 0.001°
γ	109.26 ± 0.001°
Cell volume	1950.3 ± 0.14 Å³
Cell temperature	150 K
Ambient diffraction temperature	150 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.044
Residual factor for significantly intense reflections	0.0321
Weighted residual factors for significantly intense reflections	0.073
Weighted residual factors for all reflections included in the refinement	0.0788
Goodness-of-fit parameter for all reflections included in the refinement	1.007
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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