Information card for entry 7020855
Formula
C28 H52 N2 O9 S4 W
Calculated formula
C28 H52 N2 O9 S4 W
Title of publication
A new series of bis(ene-1,2-dithiolato)tungsten(iv), -(v), -(vi) complexes as reaction centre models of tungsten enzymes: Preparation, crystal structures and spectroscopic properties.
Authors of publication
Sugimoto, Hideki; Hatakeda, Kohei; Toyota, Kazuo; Tatemoto, Susumu; Kubo, Minoru; Ogura, Takashi; Itoh, Shinobu
Journal of publication
Dalton transactions (Cambridge, England : 2003)
Year of publication
2013
Journal volume
42
Journal issue
9
Pages of publication
3059 - 3070
a
20.0069 ± 0.0008 Å
b
9.2346 ± 0.0004 Å
c
20.0827 ± 0.0007 Å
α
90°
β
94.0939 ± 0.0012°
γ
90°
Cell volume
3700.9 ± 0.3 Å3
Cell temperature
103 K
Ambient diffraction temperature
103 K
Number of distinct elements
6
Space group number
13
Hermann-Mauguin space group symbol
P 1 2/n 1
Hall space group symbol
-P 2yac
Residual factor for significantly intense reflections
0.0258
Weighted residual factors for all reflections included in the refinement
0.0549
Goodness-of-fit parameter for all reflections included in the refinement
0.971
Diffraction radiation wavelength
0.71075 Å
Diffraction radiation type
MoKα
Has coordinates
Yes
Has disorder
No
Has Fobs
No
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https://www.crystallography.net/7020855.html