Crystallography Open Database

Information card for entry 4312389

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Coordinates	4312389.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H16 Br9 Cl Cu6 S16
Calculated formula	C20 H16 Br9 Cl Cu6 S16
Title of publication	Novel ET-Coordinated Copper(I) Complexes: Syntheses, Structures, and Physical Properties (ET = BEDT-TTF = Bis(ethylenedithio)tetrathiafulvalene)
Authors of publication	Ryo Kanehama; Masamichi Umemiya; Fumiyasu Iwahori; Hitoshi Miyasaka; Ken-ichi Sugiura; Masahiro Yamashita; Yasukata Yokochi; Hiroshi Ito; Shin-ichi Kuroda; Hideo Kishida; Hiroshi Okamoto
Journal of publication	Inorganic Chemistry
Year of publication	2003
Journal volume	42
Pages of publication	7173 - 7181
a	14.708 ± 0.004 Å
b	9.219 ± 0.002 Å
c	17.087 ± 0.005 Å
α	90°
β	110.62 ± 0.003°
γ	90°
Cell volume	2168.5 ± 1 Å³
Cell temperature	153.1 K
Number of distinct elements	6
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for significantly intense reflections	0.1002
Weighted residual factors for all reflections included in the refinement	0.2438
Goodness-of-fit parameter for all reflections included in the refinement	1.356
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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