Crystallography Open Database

Information card for entry 2204238

2204237 << 2204238 >> 2204239

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Coordinates	Coordinates are not available: file is not found.
Structure factors	2204238.hkl
Original IUCr paper	HTML

Structure parameters

Formula	C23 H23 Cl2 N5 O5 Zn
Calculated formula	C23 H23 Cl2 N5 O5 Zn
SMILES	[Zn]1234(Cl)[N](Cc5[n]1cccc5)(Cc1[n]2cccc1)C(c1[n]3cccc1)c1[n]4cccc1.Cl(=O)(=O)(=O)[O-].O
Title of publication	{<i>N</i>-[Bis(2-pyridyl)methyl]-<i>N,N</i>-bis(2-pyridyl)methylamine-κ^5^<i>N</i>}chlorozinc(II) perchlorate monohydrate
Authors of publication	Kojima, Takahiko; Weber, David M.; Choma, Christin T.
Journal of publication	Acta Crystallographica Section E
Year of publication	2004
Journal volume	60
Journal issue	9
Pages of publication	m1291 - m1292
a	14.635 ± 0.007 Å
b	12.476 ± 0.005 Å
c	15.314 ± 0.007 Å
α	90°
β	115.726 ± 0.005°
γ	90°
Cell volume	2519 ± 2 Å³
Cell temperature	113.2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for significantly intense reflections	0.056
Weighted residual factors for all reflections included in the refinement	0.163
Goodness-of-fit parameter for all reflections included in the refinement	1.512
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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