Crystallography Open Database

Information card for entry 4128332

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Coordinates	4128332.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C229 H96 Au24 Cl2 F108 P2 Pd
Calculated formula	C229 H96 Au24 Cl2 F108 P2 Pd
Title of publication	Efficient and Selective Conversion of Phosphine-Protected (MAu<sub>8</sub>)<sup>2+</sup> (M = Pd, Pt) Superatoms to Thiolate-Protected (MAu<sub>12</sub>)<sup>6+</sup> or Alkynyl-Protected (MAu<sub>12</sub>)<sup>4+</sup> Superatoms via Hydride Doping.
Authors of publication	Takano, Shinjiro; Ito, Shun; Tsukuda, Tatsuya
Journal of publication	Journal of the American Chemical Society
Year of publication	2019
Journal volume	141
Journal issue	40
Pages of publication	15994 - 16002
a	17.477 ± 0.004 Å
b	20.733 ± 0.004 Å
c	35.724 ± 0.007 Å
α	90°
β	95.792 ± 0.003°
γ	90°
Cell volume	12879 ± 5 Å³
Cell temperature	93 ± 2 K
Ambient diffraction temperature	93 ± 2 K
Number of distinct elements	7
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/n 1
Hall space group symbol	-P 2yac
Residual factor for all reflections	0.0725
Residual factor for significantly intense reflections	0.0633
Weighted residual factors for significantly intense reflections	0.1563
Weighted residual factors for all reflections included in the refinement	0.1632
Goodness-of-fit parameter for all reflections included in the refinement	1.124
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
221455 (current)	2019-11-03	cif/ Adding structures of 4128332 via cif-deposit CGI script.	4128332.cif