Crystallography Open Database

Information card for entry 7019812

7019811 << 7019812 >> 7019813

Preview

Coordinates	7019812.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C80 H112 N8 O8 Zn3
Calculated formula	C80 H112 N8 O8 Zn3
Title of publication	Metal-directed assembly of chiral bis-Zn(ii) Schiff base structures.
Authors of publication	Escárcega-Bobadilla, Martha V; Anselmo, Daniele; Wezenberg, Sander J.; Escudero-Adán, Eduardo C; Martínez Belmonte, Marta; Martin, Eddy; Kleij, Arjan W.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2012
Journal volume	41
Journal issue	32
Pages of publication	9766 - 9772
a	15.2147 ± 0.0015 Å
b	17.6284 ± 0.0018 Å
c	17.8255 ± 0.0016 Å
α	112.366 ± 0.003°
β	113.184 ± 0.002°
γ	90.041 ± 0.003°
Cell volume	4000.1 ± 0.7 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1338
Residual factor for significantly intense reflections	0.0723
Weighted residual factors for significantly intense reflections	0.1959
Weighted residual factors for all reflections included in the refinement	0.2403
Goodness-of-fit parameter for all reflections included in the refinement	1.045
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
179902 (current)	2016-03-25	cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/98.	7019812.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7019812.cif
64318	2012-08-12	cif/ Adding structures of 7019812, 7019813 via cif-deposit CGI script.	7019812.cif