Crystallography Open Database

Information card for entry 4341693

Preview

Coordinates	4341693.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	TiOBut OBc 1:4
Formula	C19 H36 O7 Ti
Calculated formula	C19 H36 O7 Ti
Title of publication	Synthesis and Structural Characterization of Group 4 Metal Carboxylates for Nanowire Production.
Authors of publication	Boyle, Timothy J.; Yonemoto, Daniel T.; Doan, Thu Q.; Alam, Todd M.
Journal of publication	Inorganic chemistry
Year of publication	2014
Pages of publication	141117102556003
a	15.9892 ± 0.0011 Å
b	8.1331 ± 0.0006 Å
c	9.2864 ± 0.0005 Å
α	90°
β	90°
γ	90°
Cell volume	1207.62 ± 0.14 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	4
Space group number	31
Hermann-Mauguin space group symbol	P m n 21
Hall space group symbol	P 2ac -2
Residual factor for all reflections	0.1242
Residual factor for significantly intense reflections	0.0617
Weighted residual factors for significantly intense reflections	0.1438
Weighted residual factors for all reflections included in the refinement	0.1892
Goodness-of-fit parameter for all reflections included in the refinement	0.934
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
179519 (current)	2016-03-23	cif/4/34/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/34/16.	4341693.cif
127630	2014-11-21	cif/ Adding structures of 4341693, 4341694, 4341695, 4341696, 4341697, 4341698, 4341699 via cif-deposit CGI script.	4341693.cif