Crystallography Open Database

Information card for entry 1505135

Preview

Coordinates	1505135.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H30 N O
Calculated formula	C20 H30 N O
Title of publication	Synthesis and Evaluation of Sterically Hindered 1,1-Diadamantyl Nitroxide as a Low-Temperature Mediator for the Stable Free Radical Polymerization Process
Authors of publication	Debuigne, Antoine; Chan-Seng, Delphine; Li, Lichun; Hamer, Gordon K.; Georges, Michael K.
Journal of publication	Macromolecules
Year of publication	2007
Journal volume	40
Journal issue	17
Pages of publication	6224
a	20.64 ± 0.0004 Å
b	6.718 ± 0.0008 Å
c	11.579 ± 0.0007 Å
α	90°
β	90°
γ	90°
Cell volume	1605.5 ± 0.2 Å³
Cell temperature	150 ± 1 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	4
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Residual factor for all reflections	0.1234
Residual factor for significantly intense reflections	0.0651
Weighted residual factors for significantly intense reflections	0.1733
Weighted residual factors for all reflections included in the refinement	0.2025
Goodness-of-fit parameter for all reflections included in the refinement	1.063
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.	1505135.cif
120071	2014-07-11	Adding DOIs to range 1 structures.	1505135.cif
45374	2012-03-20	../uploads/cif-deposit/cod/cif Adding structures of 1505135 via cif-deposit CGI script.	1505135.cif