Crystallography Open Database

Information card for entry 4305922

Preview

Coordinates	4305922.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C23 H26 F3 N5 O3 Pt S
Calculated formula	C23 H26 F3 N5 O3 Pt S
SMILES	[Pt]12([n]3n(Cc4c2c(ccc4)C[n]2n1ccc2)ccc3)([NH2]c1ccccc1)(C)C.S(=O)(=O)([O-])C(F)(F)F
Title of publication	Preparation and Reactivity of a Monomeric Octahedral Platinum(IV) Amido Complex
Authors of publication	Colleen Munro-Leighton; Yuee Feng; Jubo Zhang; Nikki M. Alsop; T. Brent Gunnoe; Paul D. Boyle; Jeffrey L. Petersen
Journal of publication	Inorganic Chemistry
Year of publication	2008
Journal volume	47
Pages of publication	6124 - 6126
a	10.218 ± 0.0004 Å
b	14.7175 ± 0.0005 Å
c	16.5683 ± 0.0006 Å
α	90°
β	92.6825 ± 0.0018°
γ	90°
Cell volume	2488.87 ± 0.16 Å³
Cell temperature	110 K
Ambient diffraction temperature	110 K
Number of distinct elements	7
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	0.0378
Residual factor for significantly intense reflections	0.0239
Weighted residual factors for significantly intense reflections	0.0418
Weighted residual factors for all reflections included in the refinement	0.0449
Goodness-of-fit parameter for all reflections included in the refinement	1.033
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179097 (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 4/30/59.	4305922.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4305922.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4305922.cif
1167	2010-05-13	cif/ Adding data from the rest of 2009 RSC journals, Inorg-Chem-2008 and Chem-Comm-2010_18-19.	4305922.cif