Crystallography Open Database

Information card for entry 4112541

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Structure parameters

Common name	para-tolualdehyde N-tert-butyldimethylsilylhydrozone
Formula	C14 H24 N2 Si
Calculated formula	C14 H24 N2 Si
SMILES	[Si](N/N=C/c1ccc(cc1)C)(C)(C)C(C)(C)C
Title of publication	Practical Procedures for the Preparation of N-tert-Butyldimethylsilylhydrazones and Their Use in Modified Wolff-Kishner Reductions and in the Synthesis of Vinyl Halides and gem-Dihalides
Authors of publication	Michael E. Furrow; Andrew G. Myers
Journal of publication	Journal of the American Chemical Society
Year of publication	2004
Journal volume	126
Pages of publication	5436 - 5445
a	6.8315 ± 0.0015 Å
b	7.4154 ± 0.0016 Å
c	30.72 ± 0.007 Å
α	90°
β	93.928 ± 0.005°
γ	90°
Cell volume	1552.6 ± 0.6 Å³
Cell temperature	193 ± 2 K
Ambient diffraction temperature	193 ± 2 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1493
Residual factor for significantly intense reflections	0.0766
Weighted residual factors for significantly intense reflections	0.1284
Weighted residual factors for all reflections included in the refinement	0.1475
Goodness-of-fit parameter for all reflections included in the refinement	0.99
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
301833 (current)	2025-08-20	Add cross-references to PubChem compounds in COD range 4/11/ Each referenced PubChem compound corresponds to the full crystal structure.	4112541.cif
178896	2016-03-22	cif/4/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/11/25.	4112541.cif
120077	2014-07-12	Adding DOIs to range 4/11 structures.	4112541.cif
64933	2012-08-30	cif/ Adding structures of 4112541 via cif-deposit CGI script.	4112541.cif