Crystallography Open Database

Information card for entry 7113231

Preview

Coordinates	7113231.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C105 H87.5 Ag6 Cl9.5 F3 Fe3 O3 P6 S
Calculated formula	C105 H87.5 Ag6 Cl9.5 F3 Fe3 O3 P6 S
Title of publication	General formation of trigonal-prismatic [Ag~6~X~5~(dppf)~3~]^+^ (X = Cl, Br, I) through an unusual ligand migration from NiX2(dppf) to AgOTf
Authors of publication	Teo, Peili; Koh, Lip Lin; Hor, T. S. Andy
Journal of publication	Chemical Communications (Cambridge, United Kingdom)
Year of publication	2007
Journal issue	41
Pages of publication	4221 - 4223
a	14.3332 ± 0.0009 Å
b	16.8136 ± 0.001 Å
c	22.5538 ± 0.0013 Å
α	82.969 ± 0.001°
β	79.373 ± 0.001°
γ	85.157 ± 0.002°
Cell volume	5291.2 ± 0.6 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	9
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0681
Residual factor for significantly intense reflections	0.0502
Weighted residual factors for significantly intense reflections	0.1104
Weighted residual factors for all reflections included in the refinement	0.1182
Goodness-of-fit parameter for all reflections included in the refinement	1.049
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Duplicate of	7102211
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
209690 (current)	2018-08-14	cif/7/ Updating bibliography in entries 7102211-7102216, 7113231-7113236. Marking entries 7113231-7113236 as duplicates of entries 7102211-7102216.	7113231.cif
176453	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7113231.cif
113395	2014-05-12	cif/ Adding structures of 7113231, 7113232, 7113233, 7113234, 7113235, 7113236 via cif-deposit CGI script.	7113231.cif