Crystallography Open Database

Information card for entry 4102044

4102043 << 4102044 >> 4102045

Preview

Coordinates	4102044.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C4.92 F0.82 N1.64 O48 Si24
Calculated formula	C4.8 F0.8 N1.6 O48 Si24
Title of publication	In SituTransformation of TON Silica Zeolite into the Less Dense ITW: Structure-Direction Overcoming Framework Instability in the Synthesis of SiO2 Zeolites
Authors of publication	Claudio M. Zicovich-Wilson; Felipe Gándara; Angeles Monge; Miguel A. Camblor
Journal of publication	Journal of the American Chemical Society
Year of publication	2010
Journal volume	132
Pages of publication	3461 - 3471
a	13.723 ± 0.002 Å
b	17.458 ± 0.003 Å
c	5.0756 ± 0.0008 Å
α	90°
β	90°
γ	90°
Cell volume	1216 ± 0.3 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	295 ± 2 K
Number of distinct elements	5
Space group number	36
Hermann-Mauguin space group symbol	C m c 21
Hall space group symbol	C 2c -2
Residual factor for all reflections	0.0789
Residual factor for significantly intense reflections	0.0618
Weighted residual factors for significantly intense reflections	0.149
Weighted residual factors for all reflections included in the refinement	0.1572
Goodness-of-fit parameter for all reflections included in the refinement	1.056
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
178766 (current)	2016-03-21	cif/4/10/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/10/20.	4102044.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4102044.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4102044.cif
24866	2011-09-08	../uploads/cif-deposit/cod/cif Adding structures of 4102044 via cif-deposit CGI script.	4102044.cif