Crystallography Open Database

Information card for entry 4107604

Preview

Coordinates	4107604.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Ge39.56 N16 O118 Si12.44
Calculated formula	Ge39.564 N16 O118 Si12.436
Title of publication	An Open-Framework Silicogermanate with 26-Ring Channels Built from Seven-Coordinated (Ge,Si)10(O,OH)28 Clusters
Authors of publication	Kirsten E. Christensen; Charlotte Bonneau; Mikaela Gustafsson; Lei Shi; Junliang Sun; Jekabs Grins; Kjell Jansson; Isabelle Sbille; Bao-Lian Su; Xiadong Zou
Journal of publication	Journal of the American Chemical Society
Year of publication	2008
Journal volume	130
Pages of publication	3758 - 3759
a	34.476 ± 0.003 Å
b	19.8768 ± 0.0017 Å
c	14.8594 ± 0.0008 Å
α	90°
β	90°
γ	90°
Cell volume	10182.7 ± 1.4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	63
Hermann-Mauguin space group symbol	C m c m
Hall space group symbol	-C 2c 2
Residual factor for all reflections	0.0701
Residual factor for significantly intense reflections	0.0563
Weighted residual factors for significantly intense reflections	0.1496
Weighted residual factors for all reflections included in the refinement	0.159
Goodness-of-fit parameter for all reflections included in the refinement	1.046
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.907 Å
Diffraction radiation type	synchrotron
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
178822 (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 4/10/76.	4107604.cif
120076	2014-07-11	Adding DOIs to range 4/10 structures.	4107604.cif
55290	2012-05-04	cif/ Adding structures of 4107604 via cif-deposit CGI script.	4107604.cif