Crystallography Open Database

Information card for entry 2239105

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Structure parameters

Chemical name	Iodidobis(morpholine-4-carbodithioato-κ^2^<i>S</i>,<i>S</i>')(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')bismuth(III)
Formula	C24 H28 Bi I N4 S4
Calculated formula	C24 H28 Bi I N4 S4
SMILES	[Bi]123(I)([n]4cccc5c4c4[n]1cccc4cc5)([S]=C(N1CCCCC1)S2)SC(=[S]3)N1CCCCC1
Title of publication	Iodidobis(morpholine-4-carbodithioato-κ^2^<i>S</i>,<i>S</i>')(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')bismuth(III)
Authors of publication	Li, Feng; Yin, Handong; Wu, Guoxing
Journal of publication	Acta Crystallographica Section E
Year of publication	2014
Journal volume	70
Journal issue	1
Pages of publication	m20
a	14.782 ± 0.004 Å
b	10.883 ± 0.003 Å
c	18.03 ± 0.004 Å
α	90°
β	100.035 ± 0.004°
γ	90°
Cell volume	2856.2 ± 1.3 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0544
Residual factor for significantly intense reflections	0.0361
Weighted residual factors for significantly intense reflections	0.0889
Weighted residual factors for all reflections included in the refinement	0.0999
Goodness-of-fit parameter for all reflections included in the refinement	1
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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