Crystallography Open Database

Information card for entry 8000092

Preview

Coordinates	8000092.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	[LZn7O(OAc)6] 2EtOAc THF
Formula	C90 H114 N6 O30 Zn7
Calculated formula	C90 H114 N6 O30 Zn7
Title of publication	Efficient Formation of Homo and Hetero Metal Clusters by Triangular Trisaloph Ligand as a Partial Template
Authors of publication	Nabeshima, Tatsuya; Miyazaki, Hayato; Iwasaki, Atsushi; Akine, Shigehisa; Saiki, Toshiyuki; Ikeda, Chusaku; Sato, Soichi
Journal of publication	Chemistry Letters
Year of publication	2006
Journal volume	35
Journal issue	9
Pages of publication	1070
a	15.13 ± 0.016 Å
b	36.38 ± 0.03 Å
c	18.32 ± 0.02 Å
α	90°
β	107.12 ± 0.06°
γ	90°
Cell volume	9637 ± 17 Å³
Cell temperature	120 K
Ambient diffraction temperature	120 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0973
Residual factor for significantly intense reflections	0.0698
Weighted residual factors for significantly intense reflections	0.1673
Weighted residual factors for all reflections included in the refinement	0.1792
Goodness-of-fit parameter for all reflections included in the refinement	1.048
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
211175 (current)	2018-09-26	cif/ Removing _chemical_name_systematic and _chemical_name_common data items with placeholder values from 513 entries in range 8.	8000092.cif
176728	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 8.	8000092.cif
94248	2014-01-22	cif/ Adding structures of 8000092 via cif-deposit CGI script.	8000092.cif