Crystallography Open Database

Information card for entry 7238284

Preview

Coordinates	7238284.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	Zn(OH2)2 (Ac2N-(CH2)6-NAc2)
Formula	C14 H28 Cl2 N2 O14 Zn
Calculated formula	C14 H28 Cl2 N2 O14 Zn
Title of publication	Effective double-ended chelating agents: crystal structures of N,N,N′,N′-tetraacetyl diamino derivatives and their chelates
Authors of publication	Aakeröy, Christer B.; Desper, John; Haque, Naheed; Hussain, Izhar
Journal of publication	CrystEngComm
Year of publication	2010
Journal volume	12
Journal issue	10
Pages of publication	3218
a	20.223 ± 0.003 Å
b	7.9438 ± 0.0012 Å
c	14.875 ± 0.002 Å
α	90°
β	97.797 ± 0.009°
γ	90°
Cell volume	2367.5 ± 0.6 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/c 1
Hall space group symbol	-P 2yc
Residual factor for all reflections	0.1386
Residual factor for significantly intense reflections	0.0714
Weighted residual factors for significantly intense reflections	0.1623
Weighted residual factors for all reflections included in the refinement	0.1895
Goodness-of-fit parameter for all reflections included in the refinement	0.874
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
244105 (current)	2019-11-28	cif/ Adding structures of 7238276, 7238277, 7238278, 7238279, 7238280, 7238281, 7238282, 7238283, 7238284 via cif-deposit CGI script.	7238284.cif