Crystallography Open Database

Information card for entry 4324169

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Structure parameters

Formula	C7 H12 Cl3 N3 Si
Calculated formula	C7 H12 Cl3 N3 Si
Title of publication	Neutral Pentacoordinate Silicon Fluorides Derived from Amidinate, Guanidinate, and Triazapentadienate Ligands and Base-Induced Disproportionation of Si2Cl6 to Stable Silylenes
Authors of publication	Rajendra S. Ghadwal; Kevin Pröpper; Birger Dittrich; Peter G. Jones; Herbert W. Roesky
Journal of publication	Inorganic Chemistry
Year of publication	2011
Journal volume	50
Pages of publication	358 - 364
a	10.6177 ± 0.0003 Å
b	8.123 ± 0.002 Å
c	13.5089 ± 0.0004 Å
α	90°
β	101.155 ± 0.01°
γ	90°
Cell volume	1143.1 ± 0.3 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0234
Residual factor for significantly intense reflections	0.0243
Weighted residual factors for all reflections included in the refinement	0.0358
Goodness-of-fit parameter for all reflections included in the refinement	3.1393
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
301838 (current)	2025-08-21	Add cross-references to PubChem compounds in COD range 4/32/ Each referenced PubChem compound corresponds to the full crystal structure.	4324169.cif
179344	2016-03-23	cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/41.	4324169.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4324169.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4324169.cif
24460	2011-08-23	../uploads/cif-deposit/cod/cif Adding structures of 4324169 via cif-deposit CGI script.	4324169.cif