Crystallography Open Database

Information card for entry 7026403

Preview

Coordinates	7026403.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H38 N6 O2 Si
Calculated formula	C28 H38 N6 O2 Si
SMILES	O=C=N[Si]12([N](=C(c3ccccc3)N1C(C)C)C(C)C)([N](=C(c1ccccc1)N2C(C)C)C(C)C)N=C=O
Title of publication	Novel neutral hexacoordinate silicon(IV) complexes with two bidentate monoanionic benzamidinato ligands.
Authors of publication	Junold, Konstantin; Burschka, Christian; Bertermann, Rüdiger; Tacke, Reinhold
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2010
Journal volume	39
Journal issue	39
Pages of publication	9401 - 9413
a	10.222 ± 0.0018 Å
b	8.1615 ± 0.001 Å
c	18.248 ± 0.003 Å
α	90°
β	105.75 ± 0.02°
γ	90°
Cell volume	1465.2 ± 0.4 Å³
Cell temperature	243 ± 2 K
Ambient diffraction temperature	243 ± 2 K
Number of distinct elements	5
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/c 1
Hall space group symbol	-P 2yc
Residual factor for all reflections	0.0626
Residual factor for significantly intense reflections	0.0454
Weighted residual factors for significantly intense reflections	0.1236
Weighted residual factors for all reflections included in the refinement	0.1332
Goodness-of-fit parameter for all reflections included in the refinement	1.069
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
179970 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/64.	7026403.cif
93489	2014-01-13	cif/ Adding structures of 7026399, 7026400, 7026401, 7026402, 7026403, 7026404, 7026405, 7026406, 7026407 via cif-deposit CGI script.	7026403.cif