Crystallography Open Database

Information card for entry 4311135

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Coordinates	4311135.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H16 Au Cl10 O4 Tl
Calculated formula	C22 H16 Au Cl10 O4 Tl
Title of publication	A Detailed Study of the Vapochromic Behavior of {Tl[Au(C6Cl5)2]}n
Authors of publication	Eduardo J. Fernández; José M. López-de-Luzuriaga; Miguel Monge; Manuel Montiel; M. Elena Olmos; Javier Pérez; Antonio Laguna; Fernando Mendizabal; Ahmed A. Mohamed; John P. Fackler
Journal of publication	Inorganic Chemistry
Year of publication	2004
Journal volume	43
Pages of publication	3573 - 3581
a	9.8654 ± 0.0002 Å
b	29.857 ± 0.0005 Å
c	11.6067 ± 0.0002 Å
α	90°
β	114.593 ± 0.0006°
γ	90°
Cell volume	3108.64 ± 0.1 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0606
Residual factor for significantly intense reflections	0.0485
Weighted residual factors for significantly intense reflections	0.1175
Weighted residual factors for all reflections included in the refinement	0.1256
Goodness-of-fit parameter for all reflections included in the refinement	1.052
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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