Crystallography Open Database

Information card for entry 8000119

Preview

Coordinates	8000119.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	[L2Zn2La(OAc)2](NO3) 2H2O EtOH 1/2hex
Formula	C45 H59 La N5 O22 Zn2
Calculated formula	C45 H57 La N5 O22 Zn2
Title of publication	Heterometallic Zn2La and ZnLu Complexes Formed by Site-selective Transmetalation of a Dimeric Homotrinuclear Zinc(II) Complex
Authors of publication	Akine, Shigehisa; Taniguchi, Takanori; Nabeshima, Tatsuya
Journal of publication	Chemistry Letters
Year of publication	2006
Journal volume	35
Journal issue	6
Pages of publication	604
a	12.0194 ± 0.0007 Å
b	14.5924 ± 0.0013 Å
c	16.5166 ± 0.0014 Å
α	98.913 ± 0.004°
β	101.516 ± 0.0013°
γ	108.111 ± 0.0009°
Cell volume	2623.7 ± 0.4 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.053
Residual factor for significantly intense reflections	0.0382
Weighted residual factors for significantly intense reflections	0.1087
Weighted residual factors for all reflections included in the refinement	0.1215
Goodness-of-fit parameter for all reflections included in the refinement	1.045
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.	8000119.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.	8000119.cif
94267	2014-01-22	cif/ Adding structures of 8000119 via cif-deposit CGI script.	8000119.cif