Crystallography Open Database

Information card for entry 7053315

Preview

Coordinates	7053315.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C37 H29 Mn N5 O7 S
Calculated formula	C37 H29 Mn N5 O7 S
Title of publication	Supramolecular assembly under the control of the chelating ligand for the MnII/bridging ligands/3-sulfobenzoate system and catalytic properties for the disproportionation of hydrogen peroxide
Authors of publication	Miao, Xiao-He; Zhu, Long-Guan
Journal of publication	New Journal of Chemistry
Year of publication	2010
Journal volume	34
Journal issue	11
Pages of publication	2403
a	10.7849 ± 0.0015 Å
b	11.3475 ± 0.0016 Å
c	14.816 ± 0.002 Å
α	100.909 ± 0.001°
β	97.804 ± 0.001°
γ	109.911 ± 0.001°
Cell volume	1634.2 ± 0.4 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	295 ± 2 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	0.0487
Residual factor for significantly intense reflections	0.0392
Weighted residual factors for significantly intense reflections	0.0946
Weighted residual factors for all reflections included in the refinement	0.0999
Goodness-of-fit parameter for all reflections included in the refinement	1.067
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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