Crystallography Open Database

Information card for entry 7021447

Preview

Coordinates	7021447.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	18-Crown-6-potassium triphenyl-carbon
Formula	C31 H39 K O6
Calculated formula	C31 H39 K O6
Title of publication	On the structural diversity of [K(18-crown-6)EPh3] complexes (E = C, Si, Ge, Sn, Pb): synthesis, crystal structures and NOESY NMR study.
Authors of publication	Kleeberg, Christian
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2013
Journal volume	42
Journal issue	23
Pages of publication	8276 - 8287
a	9.8014 ± 0.0005 Å
b	28.7693 ± 0.0014 Å
c	19.737 ± 0.001 Å
α	90°
β	90.447 ± 0.005°
γ	90°
Cell volume	5565.3 ± 0.5 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	4
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0743
Residual factor for significantly intense reflections	0.0422
Weighted residual factors for significantly intense reflections	0.0735
Weighted residual factors for all reflections included in the refinement	0.0781
Goodness-of-fit parameter for all reflections included in the refinement	0.869
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
179919 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/14.	7021447.cif
86945	2013-07-12	cif/ Adding structures of 7021446, 7021447, 7021448, 7021449, 7021450, 7021451 via cif-deposit CGI script.	7021447.cif