Crystallography Open Database

Information card for entry 1549564

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Coordinates	1549564.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	Compound 6
Formula	C23 H30 N2
Calculated formula	C23 H30 N2
Title of publication	Polarized olefins as enabling (co)catalysts for the polymerization of γ-butyrolactone
Authors of publication	Walther, Patrick; Frey, Wolfgang; Naumann, Stefan
Journal of publication	Polymer Chemistry
Year of publication	2018
Journal volume	9
Journal issue	26
Pages of publication	3674
a	15.5646 ± 0.0019 Å
b	7.8895 ± 0.0009 Å
c	15.9608 ± 0.0017 Å
α	90°
β	90°
γ	90°
Cell volume	1959.9 ± 0.4 Å³
Cell temperature	130 ± 2 K
Ambient diffraction temperature	130 ± 2 K
Number of distinct elements	3
Space group number	60
Hermann-Mauguin space group symbol	P b c n
Hall space group symbol	-P 2n 2ab
Residual factor for all reflections	0.083
Residual factor for significantly intense reflections	0.0551
Weighted residual factors for significantly intense reflections	0.1529
Weighted residual factors for all reflections included in the refinement	0.1664
Goodness-of-fit parameter for all reflections included in the refinement	1.044
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
230961 (current)	2019-11-17	cif/ Updating files of 1549564 Original log message: Adding full bibliography for 1549564.cif.	1549564.cif
208482	2018-06-18	cif/ Adding structures of 1549564 via cif-deposit CGI script.	1549564.cif