Crystallography Open Database

Information card for entry 7037286

Preview

Coordinates	7037286.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C23 H26 Cl F3 Fe N3 O4 P S
Calculated formula	C23 H26 Cl F3 Fe N3 O4 P S
Title of publication	Sterically-constrained tripodal phosphorus-bridged tris-pyridyl ligands.
Authors of publication	Hanf, Schirin; García-Rodríguez, Raúl; Bond, Andrew D.; Hey-Hawkins, Evamarie; Wright, Dominic S.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2015
Journal volume	45
Journal issue	1
Pages of publication	276 - 283
a	13.7879 ± 0.0004 Å
b	8.6473 ± 0.0002 Å
c	22.5638 ± 0.0006 Å
α	90°
β	95.0326 ± 0.0012°
γ	90°
Cell volume	2679.87 ± 0.12 Å³
Cell temperature	180 ± 2 K
Ambient diffraction temperature	180 ± 2 K
Number of distinct elements	9
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/c 1
Hall space group symbol	-P 2yc
Residual factor for all reflections	0.0424
Residual factor for significantly intense reflections	0.0359
Weighted residual factors for significantly intense reflections	0.0889
Weighted residual factors for all reflections included in the refinement	0.0935
Goodness-of-fit parameter for all reflections included in the refinement	1.06
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
176114 (current)	2016-02-05	cif/ Updating files of 7037282, 7037283, 7037284, 7037285, 7037286, 7037287 Original log message: Adding full bibliography for 7037282--7037287.cif.	7037286.cif
170381	2015-11-18	cif/ Adding structures of 7037282, 7037283, 7037284, 7037285, 7037286, 7037287 via cif-deposit CGI script.	7037286.cif