Crystallography Open Database

Information card for entry 4510369

Preview

Coordinates	4510369.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C56 H40 O20 Pb8
Calculated formula	C56 H40 O20 Pb8
Title of publication	Helical∞1[Pb2O] Chains in Polymorphs of Pb2O(C6H5COO)2
Authors of publication	Easterday, Clay C.; Dedon, Liv R.; Zeller, Matthias; Oertel, Catherine M.
Journal of publication	Crystal Growth & Design
Year of publication	2014
Journal volume	14
Journal issue	4
Pages of publication	2048
a	10.7791 ± 0.0007 Å
b	22.9541 ± 0.0016 Å
c	24.1692 ± 0.0017 Å
α	90°
β	90.212 ± 0.001°
γ	90°
Cell volume	5980 ± 0.7 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	0.04
Residual factor for significantly intense reflections	0.0374
Weighted residual factors for significantly intense reflections	0.0827
Weighted residual factors for all reflections included in the refinement	0.0841
Goodness-of-fit parameter for all reflections included in the refinement	1.004
Diffraction radiation wavelength	0.7749 Å
Diffraction radiation type	synchrotron
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179650 (current)	2016-03-24	cif/4/51/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/51/03.	4510369.cif
109064	2014-04-07	cif/ Adding structures of 4510368, 4510369, 4510370 via cif-deposit CGI script.	4510369.cif