Crystallography Open Database

Information card for entry 4314971

Preview

Coordinates	4314971.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	[(HL)2Zn3(MeOH)2(H2O)](CH2Cl2)6
Formula	C68 H76 Cl12 N8 O23 Zn3
Calculated formula	C68 H76 Cl12 N8 O23 Zn3
Title of publication	Modulation of Multimetal Complexation Behavior of Tetraoxime Ligand by Covalent Transformation of Olefinic Functionalities
Authors of publication	Shigehisa Akine; Satoko Kagiyama; Tatsuya Nabeshima
Journal of publication	Inorganic Chemistry
Year of publication	2010
Journal volume	49
Pages of publication	2141 - 2152
a	16.165 ± 0.006 Å
b	17.405 ± 0.005 Å
c	17.591 ± 0.005 Å
α	97.886 ± 0.012°
β	110.375 ± 0.013°
γ	112.294 ± 0.013°
Cell volume	4081 ± 2 Å³
Cell temperature	120 K
Ambient diffraction temperature	120 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	0.1845
Residual factor for significantly intense reflections	0.0992
Weighted residual factors for significantly intense reflections	0.2114
Weighted residual factors for all reflections included in the refinement	0.2553
Goodness-of-fit parameter for all reflections included in the refinement	1.118
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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