Crystallography Open Database

Information card for entry 7211219

Preview

Coordinates	7211219.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C26 H26 Cd N4 O10
Calculated formula	C26 H26 Cd N4 O10
Title of publication	Inclined 1D→2D polycatenation of chiral chains with large π-surfaces
Authors of publication	McCormick, Laura J.; Turner, David R.
Journal of publication	CrystEngComm
Year of publication	2013
Journal volume	15
Journal issue	41
Pages of publication	8234
a	16.724 ± 0.002 Å
b	23.732 ± 0.003 Å
c	14.189 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	5631.5 ± 1.5 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	18
Hermann-Mauguin space group symbol	P 21 21 2
Hall space group symbol	P 2 2ab
Residual factor for all reflections	0.0337
Residual factor for significantly intense reflections	0.0331
Weighted residual factors for significantly intense reflections	0.0876
Weighted residual factors for all reflections included in the refinement	0.0899
Goodness-of-fit parameter for all reflections included in the refinement	1.096
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
180443 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/12.	7211219.cif
90232	2013-11-17	cif/ Adding structures of 7211219 via cif-deposit CGI script.	7211219.cif