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Information card for 7015589

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Coordinates

7015589.cif

Structure parameters

Formula - C54 H62 Cl4 N20 O2 Ru Zn4 -
Calculated formula - C54 H62.04 Cl4 N20 O2.04 Ru Zn4 -
Title of publication Photophysical properties of Kuratowski-type coordination compounds [M(II)Zn(4)Cl(4)(Me(2)bta)(6)] (M(II) = Zn or Ru) featuring long-lived excited electronic states.
Authors of publication Liu, Ying-Ya; Grzywa, Maciej; Tonigold, Markus; Sastre, German; Schüttrigkeit, Tanja; Leeson, Nicholas S.; Volkmer, Dirk
Journal of publication Dalton transactions (Cambridge, England : 2003)
Year of publication 2011
Journal volume 40
Journal issue 22
Pages of publication 5926 - 5938
a 23.374 ± 0.003 Å
b 23.374 ± 0.003 Å
c 23.374 ± 0.003 Å
α 90°
β 90°
γ 90°
Cell volume 12770 ± 3 Å3
Cell temperature 293 ± 2 K
Ambient diffraction temperature 293 ± 2 K
Number of distinct elements 7
Hermann-Mauguin symmetry space group F d -3 m :2
Hall symmetry space group -F 4vw 2vw 3
Residual factor for all reflections 0.0302
Residual factor for observed reflections 0.0236
Weighted residual factors for the observed reflections 0.0585
Weighted residual factors for all reflections included in the refinement 0.06
Goodness-of-fit parameter for observed reflections 1.026
Diffraction radiation probe x-ray
Diffraction radiation wavelength 0.71073 Å
Diffraction radiation type MoKα
Has coordinates Yes
Has disorder Yes
Has Fobs No

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