Crystallography Open Database

Information card for entry 1516135

Preview

Coordinates	1516135.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H25 N O2 S Sn
Calculated formula	C14 H25 N O2 S Sn
SMILES	[Sn]([C@@H](NS(=O)(=O)C(C)(C)C)c1ccccc1)(C)(C)C
Title of publication	Catalytic Enantioselective Silylation of N-Sulfonylimines: Asymmetric Synthesis of α-Amino Acids from CO2 via Stereospecific Carboxylation of α-Amino Silanes.
Authors of publication	Mita, Tsuyoshi; Sugawara, Masumi; Saito, Keisuke; Sato, Yoshihiro
Journal of publication	Organic letters
Year of publication	2014
Journal volume	16
Journal issue	11
Pages of publication	3028 - 3031
a	11.1188 ± 0.0003 Å
b	10.5531 ± 0.0003 Å
c	15.6491 ± 0.0005 Å
α	90°
β	110.738 ± 0.008°
γ	90°
Cell volume	1717.26 ± 0.13 Å³
Cell temperature	93 K
Ambient diffraction temperature	93 K
Number of distinct elements	6
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for significantly intense reflections	0.017
Weighted residual factors for all reflections included in the refinement	0.0434
Goodness-of-fit parameter for all reflections included in the refinement	1.037
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176729 (current)	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.	1516135.cif
119335	2014-07-05	cif/ Updating files of 1516134, 1516135 Original log message: Adding full bibliography for 1516134--1516135.cif.	1516135.cif
113910	2014-05-17	cif/ Adding structures of 1516135 via cif-deposit CGI script.	1516135.cif