Crystallography Open Database

Information card for entry 7021451

Preview

Coordinates	7021451.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	18-Crown-6-potassium triphenyl-lead
Formula	C30 H39 K O6 Pb
Calculated formula	C30 H39 K O6 Pb
SMILES	c1(ccccc1)[Pb](c1ccccc1)c1ccccc1.[K]12345[O]6CC[O]1CC[O]2CC[O]3CC[O]4CC[O]5CC6
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	9.6839 ± 0.0004 Å
b	12.5929 ± 0.0004 Å
c	24.5776 ± 0.0008 Å
α	90°
β	90°
γ	90°
Cell volume	2997.2 ± 0.18 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0762
Residual factor for significantly intense reflections	0.038
Weighted residual factors for significantly intense reflections	0.0599
Weighted residual factors for all reflections included in the refinement	0.0698
Goodness-of-fit parameter for all reflections included in the refinement	1.016
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
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.	7021451.cif
86945	2013-07-12	cif/ Adding structures of 7021446, 7021447, 7021448, 7021449, 7021450, 7021451 via cif-deposit CGI script.	7021451.cif