Crystallography Open Database

Information card for entry 7128220

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Structure parameters

Formula	C14 H18 Ag F6 N2 P
Calculated formula	C14 H18 Ag F6 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	10.8641 ± 0.0003 Å
b	11.1767 ± 0.0002 Å
c	15.0419 ± 0.0004 Å
α	90°
β	108.62 ± 0.001°
γ	90°
Cell volume	1730.86 ± 0.07 Å³
Cell temperature	170 K
Ambient diffraction temperature	170 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0598
Residual factor for significantly intense reflections	0.0435
Weighted residual factors for significantly intense reflections	0.0971
Weighted residual factors for all reflections included in the refinement	0.1036
Goodness-of-fit parameter for all reflections included in the refinement	1.047
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
301860 (current)	2025-08-22	Add cross-references to PubChem compounds in COD range 7/12/ Each referenced PubChem compound corresponds to the full crystal structure.	7128220.cif
265853	2021-06-05	cif/ Updating files of 7128218, 7128219, 7128220, 7128221, 7128222, 7128223, 7128224, 7128225 Original log message: Adding full bibliography for 7128218--7128225.cif.	7128220.cif
264378	2021-04-22	cif/ Adding structures of 7128218, 7128219, 7128220, 7128221, 7128222, 7128223, 7128224, 7128225 via cif-deposit CGI script.	7128220.cif