Crystallography Open Database

Information card for entry 4114560

Preview

Coordinates	4114560.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C54 H70 Ag2 N8 O6
Calculated formula	C54 H52 Ag2 N8 O6
Title of publication	Efficient Aziridination of Olefins Catalyzed by a Unique Disilver(I) Compound
Authors of publication	Yong Cui; Chuan He
Journal of publication	Journal of the American Chemical Society
Year of publication	2003
Journal volume	125
Pages of publication	16202 - 16203
a	16.688 ± 0.003 Å
b	16.688 ± 0.003 Å
c	16.208 ± 0.004 Å
α	90°
β	90°
γ	120°
Cell volume	3909 ± 1.4 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	144
Hermann-Mauguin space group symbol	P 31
Hall space group symbol	P 31
Residual factor for all reflections	0.0908
Residual factor for significantly intense reflections	0.0854
Weighted residual factors for significantly intense reflections	0.2274
Weighted residual factors for all reflections included in the refinement	0.2331
Goodness-of-fit parameter for all reflections included in the refinement	1.05
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
178916 (current)	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 4/11/45.	4114560.cif
120077	2014-07-12	Adding DOIs to range 4/11 structures.	4114560.cif
67888	2012-10-05	cif/ Adding structures of 4114560 via cif-deposit CGI script.	4114560.cif