Crystallography Open Database

Information card for entry 7010005

Preview

Coordinates	7010005.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H39 Cl Cu F6 N7 O3 Sb
Calculated formula	C36 H39 Cl Cu F6 N7 O3 Sb
Title of publication	Copper(II/I) complexes of a bulky tris(pyrazolylmethyl)amine ligand
Authors of publication	Zhixuan (Jack) Chen; Natasha Karasek; Donald C. Craig; Stephen B. Colbran
Journal of publication	J. Chem. Soc., Dalton Trans.
Year of publication	2000
Journal issue	19
Pages of publication	3445 - 3452
a	11.771 ± 0.006 Å
b	12.059 ± 0.006 Å
c	13.525 ± 0.008 Å
α	89.76 ± 0.03°
β	87.17 ± 0.03°
γ	83.56 ± 0.03°
Cell volume	1905.4 ± 1.8 Å³
Cell temperature	294 K
Number of distinct elements	8
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for significantly intense reflections	0.037
Weighted residual factors for all reflections included in the refinement	0.051
Goodness-of-fit parameter for all reflections included in the refinement	1.75
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
296815 (current)	2024-12-10	Changed data names '_diffrn_reflns_{h,k,l}_min', '_diffrn_reflns_{h,k,l}_max', '_exptl_absorpt_correction_t-min' and '_exptl_absorpt_correction_t-max' to '_diffrn_reflns_limit_{h,k,l}_min', '_diffrn_reflns_{h,k,l}_max', '_exptl_absorpt_correction_T_min' and '_exptl_absorpt_correction_T_max' respectively in multiple entries.	7010005.cif
176453	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7010005.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7010005.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7010005.cif
3896	2010-12-08	cif/7/ Adding CIFs with data from Dalton-Trans-2004-2000/.	7010005.cif