Crystallography Open Database

Information card for entry 7002878

Preview

Coordinates	7002878.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	C64H44N8Pt2(C6H6O2)(PF6)4(Me2SO)9(C6H6)2
Formula	C100 H116 F24 N8 O11 P4 Pt2 S9
Calculated formula	C100 H116 F24 N8 O11 P4 Pt2 S9
Title of publication	Selective binding of benzenediol derivatives by simultaneous non-covalent interactions in bis-Pt(II) aza-aromatic host‒guest system
Authors of publication	Trokowski, Robert; Akine, Shigehisa; Nabeshima, Tatsuya
Journal of publication	Dalton Transactions
Year of publication	2009
Journal issue	46
Pages of publication	10359 - 10366
a	10.4656 ± 0.0004 Å
b	17.5215 ± 0.0007 Å
c	18.4321 ± 0.0008 Å
α	116.313 ± 0.0012°
β	94.028 ± 0.0014°
γ	99.9312 ± 0.0011°
Cell volume	2942.9 ± 0.2 Å³
Cell temperature	120 K
Ambient diffraction temperature	120 K
Number of distinct elements	8
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0792
Residual factor for significantly intense reflections	0.0707
Weighted residual factors for significantly intense reflections	0.1829
Weighted residual factors for all reflections included in the refinement	0.1983
Goodness-of-fit parameter for all reflections included in the refinement	1.061
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179732 (current)	2016-03-25	cif/7/00/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/00/28.	7002878.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7002878.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7002878.cif
1143	2010-05-03	cif/7/ Adding CIFs from Dalton-Trans-2009/ deposition.	7002878.cif