Crystallography Open Database

Information card for entry 7039348

Preview

Coordinates	7039348.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H18 F6 N5 O Pd Sb
Calculated formula	C18 H18 F6 N5 O Pd Sb
Title of publication	Divergent reactivity of platinum(ii) and palladium(ii) methylperoxo complexes and the formation of an unusual hemi-aminal complex.
Authors of publication	Petersen, Allan R.; White, Andrew J. P.; Britovsek, George J. P.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2016
Journal volume	45
Journal issue	37
Pages of publication	14520 - 14523
a	12.8162 ± 0.0003 Å
b	8.13176 ± 0.00016 Å
c	20.6429 ± 0.0005 Å
α	90°
β	100.132 ± 0.002°
γ	90°
Cell volume	2117.82 ± 0.08 Å³
Cell temperature	173 K
Ambient diffraction temperature	173 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	0.0436
Residual factor for significantly intense reflections	0.0298
Weighted residual factors for significantly intense reflections	0.0642
Weighted residual factors for all reflections included in the refinement	0.0693
Goodness-of-fit parameter for all reflections included in the refinement	1.077
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
187132 (current)	2016-10-08	cif/ Updating files of 7039348 Original log message: Adding full bibliography for 7039348.cif.	7039348.cif
183164	2016-05-31	cif/ Adding structures of 7039348 via cif-deposit CGI script.	7039348.cif