Crystallography Open Database

Information card for entry 4075561

Preview

Coordinates	4075561.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C11 H15 N O Zn
Calculated formula	C11 H15 N O Zn
Title of publication	Aminotroponate Zinc Complexes as Catalysts for the Intramolecular Hydroamination of Alkenes and Alkynes
Authors of publication	Meyer, Nils; Löhnwitz, Karolin; Zulys, Agustino; Roesky, Peter W.; Dochnahl, Maximilian; Blechert, Siegfried
Journal of publication	Organometallics
Year of publication	2006
Journal volume	25
Journal issue	15
Pages of publication	3730
a	9.581 ± 0.002 Å
b	9.2854 ± 0.0014 Å
c	12.74 ± 0.003 Å
α	90°
β	91.947 ± 0.019°
γ	90°
Cell volume	1132.7 ± 0.4 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0453
Residual factor for significantly intense reflections	0.0353
Weighted residual factors for significantly intense reflections	0.0563
Weighted residual factors for all reflections included in the refinement	0.0567
Goodness-of-fit parameter for all reflections included in the refinement	2.515
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
178644 (current)	2016-03-21	cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/55.	4075561.cif
120075	2014-07-11	Adding DOIs to range 4/07 structures.	4075561.cif
49312	2012-03-27	../uploads/cif-deposit/cod/cif Adding structures of 4075561, 4075562 via cif-deposit CGI script.	4075561.cif