Crystallography Open Database

Information card for entry 4338392

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Coordinates	4338392.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H58 Cl Fe N2 O2
Calculated formula	C38 H58 Cl Fe N2 O2
Title of publication	Fe(III) Bipyrrolidine Phenoxide Complexes and Their Oxidized Analogues.
Authors of publication	Chiang, Linus; Savard, Didier; Shimazaki, Yuichi; Thomas, Fabrice; Storr, Tim
Journal of publication	Inorganic chemistry
Year of publication	2014
Journal volume	53
Journal issue	11
Pages of publication	5810 - 5819
a	27.55 ± 0.02 Å
b	27.55 ± 0.02 Å
c	12.754 ± 0.011 Å
α	90°
β	90°
γ	120°
Cell volume	8383 ± 11 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	146
Hermann-Mauguin space group symbol	R 3 :H
Hall space group symbol	R 3
Residual factor for all reflections	0.05
Residual factor for significantly intense reflections	0.0437
Weighted residual factors for significantly intense reflections	0.1084
Weighted residual factors for all reflections included in the refinement	0.1127
Goodness-of-fit parameter for all reflections included in the refinement	1.061
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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