Crystallography Open Database

Information card for entry 4324296

Preview

Coordinates	4324296.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H46 Cl4 Co N4 O2
Calculated formula	C30 H46 Cl4 Co N4 O2
Title of publication	Heteroscorpionate-Based Co2+, Zn2+, and Cu2+ Complexes: Coordination Behavior, Aerobic Oxidation, and Hydrogen Sulfide Detection
Authors of publication	Maria Strianese; Stefano Milione; Valerio Bertolasi; Claudio Pellecchia; Alfonso Grassi
Journal of publication	Inorganic Chemistry
Year of publication	2011
Journal volume	50
Pages of publication	900 - 910
a	9.0399 ± 0.0004 Å
b	20.0369 ± 0.0008 Å
c	19.6152 ± 0.0009 Å
α	90°
β	92.4634 ± 0.0016°
γ	90°
Cell volume	3549.6 ± 0.3 Å³
Cell temperature	295 K
Ambient diffraction temperature	295 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	0.1281
Residual factor for significantly intense reflections	0.0734
Weighted residual factors for significantly intense reflections	0.1867
Weighted residual factors for all reflections included in the refinement	0.2279
Goodness-of-fit parameter for all reflections included in the refinement	1.012
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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