Crystallography Open Database

Information card for entry 4000754

Preview

Coordinates	4000754.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27 H64 O4 Sn4 Zn4
Calculated formula	C27 H64 O4 Sn4 Zn4
SMILES	[Sn]([O]12[Zn]3([O]4([Sn](C)(C)C)[Zn]5([O]3([Sn](C)(C)C)[Zn]1([O]5([Sn](C)(C)C)[Zn]24CC)CC)CC)CC)(C)(C)C.c1(ccccc1)C
Title of publication	Synthesis of Stannyl-Substituted Zn4O4Cubanes as Single-Source Precursors for Amorphous Tin-Doped ZnO and Zn2SnO4Nanocrystals and Their Potential for Thin Film Field Effect Transistor Applications
Authors of publication	Tsaroucha, Marianna; Aksu, Yilmaz; Irran, Elisabeth; Driess, Matthias
Journal of publication	Chemistry of Materials
Year of publication	2011
Journal volume	23
Journal issue	9
Pages of publication	2428
a	11.3691 ± 0.0008 Å
b	11.2041 ± 0.0006 Å
c	17.6065 ± 0.0011 Å
α	90°
β	101.148 ± 0.007°
γ	90°
Cell volume	2200.4 ± 0.2 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	5
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0776
Residual factor for significantly intense reflections	0.0669
Weighted residual factors for significantly intense reflections	0.1577
Weighted residual factors for all reflections included in the refinement	0.1639
Goodness-of-fit parameter for all reflections included in the refinement	1.107
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
178377 (current)	2016-03-21	cif/4/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/00.	4000754.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4000754.cif
34933	2012-02-26	../uploads/cif-deposit/cod/cif Adding structures of 4000754, 4000755 via cif-deposit CGI script.	4000754.cif