Crystallography Open Database

Information card for entry 4111176

Preview

Coordinates	4111176.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	[LZn2Sr(OAc)2](CH2Cl2)
Formula	C33 H34 Cl2 N4 O14 Sr Zn2
Calculated formula	C33 H34 Cl2 N4 O14 Sr Zn2
Title of publication	Helical Metallohost-Guest Complexes via Site-Selective Transmetalation of Homotrinuclear Complexes
Authors of publication	Shigehisa Akine; Takanori Taniguchi; Tatsuya Nabeshima
Journal of publication	Journal of the American Chemical Society
Year of publication	2006
Journal volume	128
Pages of publication	15765 - 15774
a	11.991 ± 0.002 Å
b	12.906 ± 0.003 Å
c	14.366 ± 0.004 Å
α	67.548 ± 0.005°
β	72.491 ± 0.007°
γ	84.174 ± 0.009°
Cell volume	1959.3 ± 0.8 Å³
Cell temperature	180 K
Ambient diffraction temperature	180 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0922
Residual factor for significantly intense reflections	0.0667
Weighted residual factors for significantly intense reflections	0.1527
Weighted residual factors for all reflections included in the refinement	0.169
Goodness-of-fit parameter for all reflections included in the refinement	1.051
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
178882 (current)	2016-03-22	cif/4/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/11/11.	4111176.cif
120077	2014-07-12	Adding DOIs to range 4/11 structures.	4111176.cif
60701	2012-06-18	cif/ Adding structures of 4111176 via cif-deposit CGI script.	4111176.cif