Crystallography Open Database

Information card for entry 4130269

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Coordinates	4130269.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C118 H96 Ag2 Au6 B4 F16 N8 P6
Calculated formula	C118 H96 Ag2 Au6 B4 F16 N8 P6
Title of publication	Structurally Well-Defined Sigmoidal Gold Clusters: Probing the Correlation between Metal Atom Arrangement and Chiroptical Response.
Authors of publication	He, Xin; Wang, Yuechao; Jiang, Hong; Zhao, Liang
Journal of publication	Journal of the American Chemical Society
Year of publication	2016
Journal volume	138
Journal issue	17
Pages of publication	5634 - 5643
a	59.465 ± 0.012 Å
b	21.294 ± 0.004 Å
c	47.96 ± 0.01 Å
α	90°
β	114.67 ± 0.03°
γ	90°
Cell volume	55186 ± 2 Å³
Cell temperature	173.15 K
Ambient diffraction temperature	173.15 K
Number of distinct elements	8
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.102
Residual factor for significantly intense reflections	0.0814
Weighted residual factors for significantly intense reflections	0.2119
Weighted residual factors for all reflections included in the refinement	0.2287
Goodness-of-fit parameter for all reflections included in the refinement	1.051
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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