Crystallography Open Database

Information card for entry 4116781

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Coordinates	4116781.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H24 Cl Mn N10 O4
Calculated formula	C10 H24 Cl Mn N10 O4
Title of publication	Nitridomanganese(V) and -(VI) Complexes Containing Macrocyclic Amine Ligands
Authors of publication	Karsten Meyer; Jesper Bendix; Nils Metzler-Nolte; Thomas Weyhermüller; Karl Wieghardt
Journal of publication	Journal of the American Chemical Society
Year of publication	1998
Journal volume	120
Pages of publication	7260 - 7270
a	9.462 ± 0.001 Å
b	9.511 ± 0.001 Å
c	11.434 ± 0.001 Å
α	79.45 ± 0.02°
β	81.07 ± 0.02°
γ	63.5 ± 0.02°
Cell volume	902.1 ± 0.2 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 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	0.0464
Residual factor for significantly intense reflections	0.0434
Weighted residual factors for all reflections	0.1206
Weighted residual factors for significantly intense reflections	0.1106
Goodness-of-fit parameter for all reflections	1.168
Goodness-of-fit parameter for significantly intense reflections	1.183
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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