Crystallography Open Database

Information card for entry 7208237

7208236 << 7208237 >> 7208238

Preview

Coordinates	7208237.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C21 H32 Cl2 Cu2 N14 O9
Calculated formula	C21 H32 Cl2 Cu2 N14 O9
Title of publication	σ-Aromaticity in dinuclear copper(ii) complexes: Novel interaction between perchlorate anion and σ-aromatic [Cu2X2] (X = N or O) core
Authors of publication	Banerjee, Ishita; Dolai, Malay; Jana, Atish Dipankar; Das, Kalyan K.; Ali, Mahammad
Journal of publication	CrystEngComm
Year of publication	2012
Journal volume	14
Journal issue	15
Pages of publication	4972
a	10.5249 ± 0.0011 Å
b	11.8458 ± 0.0013 Å
c	14.1564 ± 0.0015 Å
α	92.248 ± 0.004°
β	96.654 ± 0.003°
γ	94.316 ± 0.003°
Cell volume	1746.1 ± 0.3 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 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	0.0755
Residual factor for significantly intense reflections	0.0428
Weighted residual factors for significantly intense reflections	0.0843
Weighted residual factors for all reflections included in the refinement	0.0976
Goodness-of-fit parameter for all reflections included in the refinement	1.038
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
180413 (current)	2016-03-26	cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/82.	7208237.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7208237.cif
64230	2012-08-11	cif/ Adding structures of 7208236, 7208237 via cif-deposit CGI script.	7208237.cif