Crystallography Open Database

Information card for entry 4337867

Preview

Coordinates	4337867.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H80 O32 Pd8 S16
Calculated formula	C48 H78.5 O32 Pd8 S16
Title of publication	Tiara-like Octanuclear Palladium(II) and Platinum(II) Thiolates and Their Inclusion Complexes with Dihalo- or Iodoalkanes.
Authors of publication	Yamashina, Yukari; Kataoka, Yasutaka; Ura, Yasuyuki
Journal of publication	Inorganic chemistry
Year of publication	2014
Journal volume	53
Journal issue	7
Pages of publication	3558
a	44.2046 ± 0.0009 Å
b	58.0184 ± 0.0014 Å
c	13.2016 ± 0.0002 Å
α	90°
β	90°
γ	90°
Cell volume	33857.9 ± 1.2 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153 ± 2 K
Number of distinct elements	5
Space group number	43
Hermann-Mauguin space group symbol	F d d 2
Hall space group symbol	F 2 -2d
Residual factor for all reflections	0.0437
Residual factor for significantly intense reflections	0.0396
Weighted residual factors for significantly intense reflections	0.1021
Weighted residual factors for all reflections included in the refinement	0.1075
Goodness-of-fit parameter for all reflections included in the refinement	1.082
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
179481 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/78.	4337867.cif
109910	2014-04-17	cif/ Updating files of 4337867, 4337868, 4337869, 4337870, 4337871, 4337872, 4337873, 4337874, 4337875, 4337876 Original log message: Adding full bibliography for 4337867--4337876.cif.	4337867.cif
108457	2014-04-02	cif/ Adding structures of 4337867, 4337868, 4337869, 4337870, 4337871, 4337872, 4337873, 4337874, 4337875, 4337876 via cif-deposit CGI script.	4337867.cif