Crystallography Open Database

Information card for entry 7048650

Preview

Coordinates	7048650.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C17 H25 Cl2 Fe N2 P
Calculated formula	C17 H25 Cl2 Fe N2 P
Title of publication	PNN' & P<sub>2</sub>NN' ligands via reductive amination with phosphine aldehydes: synthesis and base-metal coordination chemistry.
Authors of publication	Gradiski, Matthew V.; Tsui, Brian T. H.; Lough, Alan J.; Morris, Robert H.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	6
Pages of publication	2150 - 2159
a	9.4667 ± 0.0003 Å
b	14.2123 ± 0.0005 Å
c	14.8138 ± 0.0006 Å
α	90°
β	103.426 ± 0.002°
γ	90°
Cell volume	1938.63 ± 0.12 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
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	0.0311
Residual factor for significantly intense reflections	0.0257
Weighted residual factors for significantly intense reflections	0.0612
Weighted residual factors for all reflections included in the refinement	0.0642
Goodness-of-fit parameter for all reflections included in the refinement	1.02
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
224149 (current)	2019-11-07	cif/ Updating files of 7048646, 7048647, 7048648, 7048649, 7048650, 7048651, 7048652, 7048653 Original log message: Adding full bibliography for 7048646--7048653.cif.	7048650.cif
213174	2019-01-17	cif/ Adding structures of 7048646, 7048647, 7048648, 7048649, 7048650, 7048651, 7048652, 7048653 via cif-deposit CGI script.	7048650.cif