Crystallography Open Database

Information card for entry 7128223

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Coordinates	7128223.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H22 F6 I N2 P
Calculated formula	C16 H22 F6 I N2 P
Title of publication	Nucleophilic iodonium interactions (NIIs) in 2-coordinate iodine(I) and silver(I) complexes.
Authors of publication	Ward, Jas S.; Frontera, Antonio; Rissanen, Kari
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2021
Journal volume	57
Journal issue	41
Pages of publication	5094 - 5097
a	17.9543 ± 0.001 Å
b	20.8051 ± 0.001 Å
c	26.6647 ± 0.001 Å
α	100.468 ± 0.004°
β	94.508 ± 0.004°
γ	106.703 ± 0.005°
Cell volume	9290.4 ± 0.8 Å³
Cell temperature	120 ± 0.1 K
Ambient diffraction temperature	120 ± 0.1 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	0.1845
Residual factor for significantly intense reflections	0.1163
Weighted residual factors for significantly intense reflections	0.2909
Weighted residual factors for all reflections included in the refinement	0.3445
Goodness-of-fit parameter for all reflections included in the refinement	1.024
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

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