Crystallography Open Database

Information card for entry 1506911

Preview

Structure parameters

Formula	C37 H45 N O2 Si Sn
Calculated formula	C37 H45 N O2 Si Sn
SMILES	[Sn]([C@H](/C=C(/[Si](C)(C)C)OC(=O)N(C(C)C)C(C)C)c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1
Title of publication	Highly enantioenriched homoenolate reagents by asymmetric gamma-deprotonation of achiral 1-silyl-substituted 1-alkenyl carbamates.
Authors of publication	Reuber, Jenny; Fröhlich, Roland; Hoppe, Dieter
Journal of publication	Organic letters
Year of publication	2004
Journal volume	6
Journal issue	5
Pages of publication	783 - 786
a	9.245 ± 0.001 Å
b	11.945 ± 0.001 Å
c	32.509 ± 0.001 Å
α	90°
β	90°
γ	90°
Cell volume	3590 ± 0.5 Å³
Cell temperature	198 ± 2 K
Ambient diffraction temperature	198 ± 2 K
Number of distinct elements	6
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0682
Residual factor for significantly intense reflections	0.0396
Weighted residual factors for significantly intense reflections	0.0607
Weighted residual factors for all reflections included in the refinement	0.0677
Goodness-of-fit parameter for all reflections included in the refinement	1.012
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
201954 (current)	2017-10-13	cif/ Marking COD entries in range 1 that are known to be related to ChemSpider entries using the _cod_related_entry data loop.	1506911.cif
176729	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1.	1506911.cif
120071	2014-07-11	Adding DOIs to range 1 structures.	1506911.cif
51540	2012-04-07	../uploads/cif-deposit/cod/cif Adding structures of 1506911 via cif-deposit CGI script.	1506911.cif