Crystallography Open Database

Information card for entry 1506186

Preview

Coordinates	1506186.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C26 H29 N O5
Calculated formula	C26 H29 N O5
Title of publication	Extending Pummerer reaction chemistry. Asymmetric synthesis of spirocyclic oxindoles via chiral indole-2-sulfoxides.
Authors of publication	Feldman, Ken S.; Karatjas, Andrew G.
Journal of publication	Organic letters
Year of publication	2006
Journal volume	8
Journal issue	18
Pages of publication	4137 - 4140
a	12.794 ± 0.003 Å
b	12.794 ± 0.003 Å
c	24.424 ± 0.007 Å
α	90°
β	90°
γ	120°
Cell volume	3462.3 ± 1.5 Å³
Cell temperature	123 ± 2 K
Ambient diffraction temperature	123 ± 2 K
Number of distinct elements	4
Space group number	154
Hermann-Mauguin space group symbol	P 32 2 1
Hall space group symbol	P 32 2"
Residual factor for all reflections	0.059
Residual factor for significantly intense reflections	0.0562
Weighted residual factors for significantly intense reflections	0.1574
Weighted residual factors for all reflections included in the refinement	0.1626
Goodness-of-fit parameter for all reflections included in the refinement	1.057
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
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.	1506186.cif
120071	2014-07-11	Adding DOIs to range 1 structures.	1506186.cif
48071	2012-03-26	../uploads/cif-deposit/cod/cif Adding structures of 1506185, 1506186 via cif-deposit CGI script.	1506186.cif