Crystallography Open Database

Information card for entry 7125383

Preview

Coordinates	7125383.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H32 Cl4 Fe2 N8 O
Calculated formula	C28 H32 Cl4 Fe2 N8 O
Title of publication	An earth-abundant system for light-driven CO<sub>2</sub> reduction to CO using a pyridinophane iron catalyst.
Authors of publication	Sakaguchi, Yuto; Call, Arnau; Cibian, Mihaela; Yamauchi, Kosei; Sakai, Ken
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2019
Journal volume	55
Journal issue	59
Pages of publication	8552 - 8555
a	9.1131 ± 0.0016 Å
b	11.477 ± 0.002 Å
c	18.784 ± 0.003 Å
α	98.812 ± 0.002°
β	92.127 ± 0.002°
γ	91.893 ± 0.002°
Cell volume	1938.6 ± 0.6 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0715
Residual factor for significantly intense reflections	0.0588
Weighted residual factors for significantly intense reflections	0.1574
Weighted residual factors for all reflections included in the refinement	0.1645
Goodness-of-fit parameter for all reflections included in the refinement	1.058
Diffraction radiation probe	x-ray
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
237840 (current)	2019-11-24	cif/ Adding structures of 7125381, 7125382, 7125383, 7125384 via cif-deposit CGI script.	7125383.cif