Crystallography Open Database

Information card for entry 4334826

Preview

Coordinates	4334826.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H48 F24 O24 Pb2 Ti2
Calculated formula	C40 H48 F24 O24 Pb2 Ti2
Title of publication	Perovskite-Structured PbTiO3 Thin Films Grown from a Single-Source Precursor
Authors of publication	Muhammad Adil Mansoor; Azhani Ismail; Rosiyah Yahya; Zainudin Arifin; Edward R. T. Tiekink; Ng Seik Weng; Muhammad Mazhar; Ali Reza Esmaeili
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	5624 - 5626
a	12.8283 ± 0.0004 Å
b	12.8833 ± 0.0003 Å
c	21.4442 ± 0.0004 Å
α	101.583 ± 0.002°
β	93.234 ± 0.002°
γ	118.803 ± 0.003°
Cell volume	2993.57 ± 0.17 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0559
Residual factor for significantly intense reflections	0.0428
Weighted residual factors for significantly intense reflections	0.104
Weighted residual factors for all reflections included in the refinement	0.114
Goodness-of-fit parameter for all reflections included in the refinement	1.025
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
179451 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/48.	4334826.cif
100710	2014-02-07	cif/ Adding structures of 4334826 via cif-deposit CGI script.	4334826.cif