Crystallography Open Database

Information card for entry 1502908

Preview

Coordinates	1502908.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H37 Ag Fe N3 O3 P S
Calculated formula	C36 H36 Ag Fe N3 O3 P S
Title of publication	Highly endo-selective and enantioselective 1,3-dipolar cycloaddition of azomethine ylide with alpha-enones catalyzed by a silver(I)/ThioClickFerrophos complex.
Authors of publication	Oura, Ichiro; Shimizu, Kenta; Ogata, Kenichi; Fukuzawa, Shin-Ichi
Journal of publication	Organic letters
Year of publication	2010
Journal volume	12
Journal issue	8
Pages of publication	1752 - 1755
a	12.266 ± 0.003 Å
b	12.266 ± 0.003 Å
c	23.225 ± 0.005 Å
α	90°
β	90°
γ	90°
Cell volume	3494.3 ± 1.4 Å³
Cell temperature	123.1 K
Number of distinct elements	8
Space group number	78
Hermann-Mauguin space group symbol	P 43
Hall space group symbol	P 4cw
Residual factor for significantly intense reflections	0.0547
Weighted residual factors for all reflections included in the refinement	0.1261
Goodness-of-fit parameter for all reflections included in the refinement	1.086
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176435 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries from ranges 1, 2.	1502908.cif
91932	2013-12-28	cif/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the range 1 CIFs.	1502908.cif
36860	2012-03-01	../uploads/cif-deposit/cod/cif Adding structures of 1502908 via cif-deposit CGI script.	1502908.cif