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Information card for 7015720

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Coordinates

7015720.cif

Structure parameters

Formula - C14 H16 Mn N9 O -
Calculated formula - C14 H16 Mn N9 O -
Title of publication Monomeric, trimeric, and tetrameric transition metal complexes (Mn, Fe, Co) containing N,N-bis(2-pyridylmethyl)-2-aminoethanol/-ate: preparation, crystal structure, molecular magnetism and oxidation catalysis.
Authors of publication Shin, Jong Won; Rowthu, Sankara Rao; Hyun, Min Young; Song, Young Joo; Kim, Cheal; Kim, Bong Gon; Min, Kil Sik
Journal of publication Dalton transactions (Cambridge, England : 2003)
Year of publication 2011
Journal volume 40
Journal issue 21
Pages of publication 5762 - 5773
a 8.6742 ± 0.0008 Å
b 13.3698 ± 0.0013 Å
c 13.6701 ± 0.0012 Å
α 90°
β 98.15 ± 0.002°
γ 90°
Cell volume 1569.3 ± 0.3 Å3
Cell temperature 293 ± 2 K
Ambient diffraction temperature 293 ± 2 K
Number of distinct elements 5
Hermann-Mauguin symmetry space group P 1 21/c 1
Hall symmetry space group -P 2ybc
Residual factor for all reflections 0.0861
Residual factor for observed reflections 0.0436
Weighted residual factors for the observed reflections 0.0888
Weighted residual factors for all reflections included in the refinement 0.1402
Goodness-of-fit parameter for observed reflections 1.183
Diffraction radiation wavelength 0.71073 Å
Diffraction radiation type MoKα
Has coordinates Yes
Has disorder No
Has Fobs No

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