Crystallography Open Database

Information card for entry 2012747

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Structure parameters

Chemical name	triaqua-1κ^3^O-μ-cyano-1:2κ^2^N:C-pentacyano-2κ^5^C-tetrakis -(2-pyrrolidone-1κO)chromium(III)dysprosium(III) dihydrate
Formula	C22 H38 Cr Dy N10 O9
Calculated formula	C22 H38 Cr Dy N10 O9
SMILES	[Dy]([OH2])([OH2])([OH2])([O]=C1NCCC1)([O]=C1NCCC1)([O]=C1NCCC1)([O]=C1NCCC1)[N]#C[Cr](C#N)(C#N)(C#N)(C#N)C#N.O.O
Title of publication	A cyano-bridged dinuclear 4<i>f</i>‒3<i>d</i> array
Authors of publication	Kou, Hui-Zhong; Gao, Song; Wang, Ru-Ji
Journal of publication	Acta Crystallographica Section C
Year of publication	2002
Journal volume	58
Journal issue	6
Pages of publication	m325 - m326
a	9.1442 ± 0.0018 Å
b	12.448 ± 0.003 Å
c	14.518 ± 0.003 Å
α	90.19 ± 0.03°
β	92.4 ± 0.03°
γ	91.1 ± 0.03°
Cell volume	1650.8 ± 0.6 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0318
Residual factor for significantly intense reflections	0.0291
Weighted residual factors for significantly intense reflections	0.0726
Weighted residual factors for all reflections included in the refinement	0.0736
Goodness-of-fit parameter for all reflections included in the refinement	1.127
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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