Crystallography Open Database

Information card for entry 7243081

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Coordinates	7243081.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	MPMB1
Formula	C33 H50 Cl4 Fe2 N8 O3
Calculated formula	C34 H56 Cl4 Fe2 N8 O5
Title of publication	μ-Oxo-bridged diiron(iii) complexes of tripodal 4N ligands as catalysts for alkane hydroxylation reaction using m-CPBA as an oxidant: substrate vs. self hydroxylation
Authors of publication	Balamurugan, Mani; Suresh, Eringathodi; Palaniandavar, Mallayan
Journal of publication	RSC Advances
Year of publication	2021
Journal volume	11
Journal issue	35
Pages of publication	21514 - 21526
a	17.8183 ± 0.0011 Å
b	23.7713 ± 0.0015 Å
c	9.3271 ± 0.0006 Å
α	90°
β	90°
γ	90°
Cell volume	3950.6 ± 0.4 Å³
Cell temperature	273 ± 2 K
Ambient diffraction temperature	273 ± 2 K
Number of distinct elements	6
Space group number	56
Hermann-Mauguin space group symbol	P c c n
Hall space group symbol	-P 2ab 2ac
Residual factor for all reflections	0.0824
Residual factor for significantly intense reflections	0.0752
Weighted residual factors for significantly intense reflections	0.1997
Weighted residual factors for all reflections included in the refinement	0.2071
Goodness-of-fit parameter for all reflections included in the refinement	1.115
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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