Crystallography Open Database

Information card for entry 2311956

2311955 << 2311956 >> 2311957

Preview

Coordinates	2311956.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	Poly[tetra-<i>n</i>-butylammonium [bis(μ~2~-dimethyldithiocarbamato)dodeca-μ~3~-iodido-hexa-μ~2~-iodido-tetracopper(I)copper(II)hexalead(II)]]
Formula	C38 H84 Cu5 I18 N4 Pb6 S4
Calculated formula	C38 H84 Cu5 I18 N4 Pb6 S4
Title of publication	Syntheses and crystal structures of two heterometallic iodoplumbates containing mixed-valence copper(I/II).
Authors of publication	Fan, Le Qing; Zhu, Xiao Tong
Journal of publication	Acta crystallographica. Section C, Structural chemistry
Year of publication	2017
Journal volume	73
Journal issue	Pt 12
Pages of publication	1098 - 1103
a	13.5451 ± 0.0018 Å
b	13.889 ± 0.0019 Å
c	14.4514 ± 0.0012 Å
α	94.449 ± 0.003°
β	92.316 ± 0.003°
γ	119.009 ± 0.004°
Cell volume	2361 ± 0.5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0847
Residual factor for significantly intense reflections	0.0544
Weighted residual factors for significantly intense reflections	0.1138
Weighted residual factors for all reflections included in the refinement	0.1277
Goodness-of-fit parameter for all reflections included in the refinement	1.071
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
246185 (current)	2019-12-26	cif/ Adding structures of 2311956, 2311957 via cif-deposit CGI script.	2311956.cif