Crystallography Open Database

Information card for entry 4308984

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Coordinates	4308984.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C56 H52 Cl2 Mn2 N14 O8
Calculated formula	C56 H52 Cl2 Mn2 N14 O8
Title of publication	Magneto-Structural Correlations: Synthesis of a Family of End-On Azido-Bridged Manganese(II) Dinuclear Compounds with S= 5 Spin Ground State
Authors of publication	Tapan K. Karmakar; Barindra K. Ghosh; A. Usman; Hoong-Kun Fun; Eric Rivière; Talal Mallah; Guillem Aromí; Swapan K. Chandra
Journal of publication	Inorganic Chemistry
Year of publication	2005
Journal volume	44
Pages of publication	2391 - 2399
a	22.2818 ± 0.0014 Å
b	17.6712 ± 0.0011 Å
c	14.3505 ± 0.0009 Å
α	90°
β	91.933 ± 0.001°
γ	90°
Cell volume	5647.2 ± 0.6 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.1194
Residual factor for significantly intense reflections	0.083
Weighted residual factors for significantly intense reflections	0.1594
Weighted residual factors for all reflections included in the refinement	0.1734
Goodness-of-fit parameter for all reflections included in the refinement	1.103
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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