Crystallography Open Database

Information card for entry 4316062

Preview

Coordinates	4316062.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H29 Cu2 N13 O
Calculated formula	C16 H29 Cu2 N13 O
Title of publication	A Unique Example of Structural and Magnetic Diversity in Four Interconvertible Copper(II)-Azide Complexes with the Same Schiff Base Ligand: A Monomer, a Dimer, a Chain, and a Layer
Authors of publication	Subrata Naiya; Chaitali Biswas; Michael G. B. Drew; Carlos J. Gómez-García; Juan M. Clemente-Juan; Ashutosh Ghosh
Journal of publication	Inorganic Chemistry
Year of publication	2010
Journal volume	49
Pages of publication	6616 - 6627
a	24.928 ± 0.005 Å
b	9.0544 ± 0.0019 Å
c	22.4116 ± 0.0019 Å
α	90°
β	119.752 ± 0.009°
γ	90°
Cell volume	4391.7 ± 1.4 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.1092
Residual factor for significantly intense reflections	0.066
Weighted residual factors for significantly intense reflections	0.1622
Weighted residual factors for all reflections included in the refinement	0.1742
Goodness-of-fit parameter for all reflections included in the refinement	0.99
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
179240 (current)	2016-03-23	cif/4/31/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/31/60.	4316062.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4316062.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4316062.cif
9237	2011-02-09	../uploads/cif-deposit/cod/cif Adding structures of 4316062 via cif-deposit CGI script.	4316062.cif