Crystallography Open Database

Information card for entry 4309969

Preview

Coordinates	4309969.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	1a'
Chemical name	tetrakis(μ~2~-Pivalamidato-N,O)-tetra-ammine-octa-chloro-penta-platinum(ii,iii)
Formula	C26 H66 Cl8 N8 O8 Pt5
Calculated formula	C26 H66 Cl8 N8 O8 Pt5
SMILES	C1(C(C)(C)C)=[NH][Pt]2([NH3])([NH]=C(C(C)(C)C)O[Pt]2(O1)(CC(=O)C)(Cl)Cl)[NH3].[Pt](Cl)(Cl)([Cl-])[Cl-].[Pt]12([NH]=C(C(C)(C)C)O[Pt]2(OC(C(C)(C)C)=[NH]1)(CC(=O)C)(Cl)Cl)([NH3])[NH3].O.O
Title of publication	Synthesis of the Pivalamidate-Bridged Pentanuclear Platinum(II,III) Linear Complexes with Pt...Pt Interactions
Authors of publication	Kazuko Matsumoto; Saiko Arai; Masahiko Ochiai; Wanzhi Chen; Ayako Nakata; Hiromi Nakai; Shuhei Kinoshita
Journal of publication	Inorganic Chemistry
Year of publication	2005
Journal volume	44
Pages of publication	8552 - 8560
a	13.052 ± 0.005 Å
b	12.092 ± 0.005 Å
c	15.99 ± 0.007 Å
α	90°
β	97.653 ± 0.005°
γ	90°
Cell volume	2501.1 ± 1.8 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0413
Residual factor for significantly intense reflections	0.0296
Weighted residual factors for significantly intense reflections	0.062
Weighted residual factors for all reflections included in the refinement	0.0668
Goodness-of-fit parameter for all reflections included in the refinement	0.992
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179137 (current)	2016-03-23	cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/99.	4309969.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4309969.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4309969.cif
5312	2011-01-03	cif/ Adding files, updated with the 'cif_fix_enum' program and the cif_core.dic dictionary. The enumerator values were fixed, mostly incorrect case, but also some values that had extra underscores, dashes or spaces. Unfortunately, 22 had non-ASCII characters with the 8-th bit set, and these got incorrectly interpreted as latin1 characters and converted to their UTF8 equivalents by Perl. To fix the structures, however, they need to be redeposited from the original files with the new CIFParser/cif_filter version.	4309969.cif
1526	2010-09-26	cif/4/ Adding new CIFs from Inorg. Chem. 2005 deposited via Web deposition site to the COD test database (and transferede to the main COD database after renaming).	4309969.cif