Crystallography Open Database

Information card for entry 7152239

Preview

Coordinates	7152239.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H30 N2
Calculated formula	C24 H30 N2
Title of publication	One-pot preparation of piperazines by regioselective ring-opening of non-activated arylaziridines.
Authors of publication	Trinchera, Piera; Musio, Biagia; Degennaro, Leonardo; Moliterni, Anna; Falcicchio, Aurelia; Luisi, Renzo
Journal of publication	Organic & biomolecular chemistry
Year of publication	2012
Journal volume	10
Journal issue	10
Pages of publication	1962 - 1965
a	8.4011 ± 0.0007 Å
b	10.0557 ± 0.0008 Å
c	13.0329 ± 0.0015 Å
α	74.541 ± 0.007°
β	78.907 ± 0.007°
γ	76.897 ± 0.006°
Cell volume	1023.28 ± 0.17 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	3
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1402
Residual factor for significantly intense reflections	0.0585
Weighted residual factors for significantly intense reflections	0.1212
Weighted residual factors for all reflections included in the refinement	0.1511
Goodness-of-fit parameter for all reflections included in the refinement	0.984
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
180308 (current)	2016-03-26	cif/7/15/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/15/22.	7152239.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7152239.cif
37733	2012-03-04	../uploads/cif-deposit/cod/cif Adding structures of 7152239, 7152240, 7152241 via cif-deposit CGI script.	7152239.cif