Crystallography Open Database

Information card for entry 4504394

Preview

Coordinates	4504394.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Zn-pyrimidine helix
Formula	C4 H14 F6 N2 O5 Si Zn
Calculated formula	C4 H14 F6 N2 O5 Si Zn
Title of publication	Enantiomorphic Helical Coordination Polymers of {[M(pyrimidine)(OH2)4][SiF6]·H2O}∞(M = Co2+, Cu2+, Zn2+)
Authors of publication	Cordes, David, B.; Rogers, Robin D.
Journal of publication	Crystal Growth & Design
Year of publication	2007
Journal volume	7
Journal issue	10
Pages of publication	1943
a	11.186 ± 0.0002 Å
b	11.186 ± 0.0002 Å
c	19.7088 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	2466.1 ± 0.08 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	7
Space group number	92
Hermann-Mauguin space group symbol	P 41 21 2
Hall space group symbol	P 4abw 2nw
Residual factor for all reflections	0.09
Residual factor for significantly intense reflections	0.0482
Weighted residual factors for significantly intense reflections	0.0755
Weighted residual factors for all reflections included in the refinement	0.0853
Goodness-of-fit parameter for all reflections included in the refinement	0.65
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
179578 (current)	2016-03-24	cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/43.	4504394.cif
120110	2014-07-12	Adding DOIs to range 4/50 structures.	4504394.cif
45102	2012-03-20	../uploads/cif-deposit/cod/cif Adding structures of 4504392, 4504393, 4504394 via cif-deposit CGI script.	4504394.cif