Crystallography Open Database

Information card for entry 7017663

Preview

Coordinates	7017663.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C6 H14 Cu2 N14
Calculated formula	C6 H14 Cu2 N14
Title of publication	Cu(II)-azide polymers with various molar equivalents of blocking diamine ligands: synthesis, structures, magnetic properties with DFT studies.
Authors of publication	Mukherjee, Sandip; Patil, Yogesh P.; Mukherjee, Partha Sarathi
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2012
Journal volume	41
Journal issue	1
Pages of publication	54 - 64
a	7.0267 ± 0.0015 Å
b	20.857 ± 0.005 Å
c	9.927 ± 0.002 Å
α	90°
β	101.113 ± 0.012°
γ	90°
Cell volume	1427.6 ± 0.5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
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	0.0919
Residual factor for significantly intense reflections	0.0546
Weighted residual factors for significantly intense reflections	0.1078
Weighted residual factors for all reflections included in the refinement	0.1266
Goodness-of-fit parameter for all reflections included in the refinement	1.041
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
179880 (current)	2016-03-25	cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/76.	7017663.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7017663.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7017663.cif
33383	2012-02-12	../uploads/cif-deposit/cod/cif Adding structures of 7017663, 7017664, 7017665, 7017666 via cif-deposit CGI script.	7017663.cif