Crystallography Open Database

Information card for entry 7045134

Preview

Coordinates	7045134.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C26 H20 Cl4 Cu3 N8 O2
Calculated formula	C26 H20 Cl4 Cu3 N8 O2
Title of publication	A new nitrogen rich open chain diazine ligand system: synthesis coordination chemistry and magneto-structural studies.
Authors of publication	Anwar, Muhammad U.; Al-Harrasi, Ahmed; Gavey, Emma L.; Pilkington, Melanie; Rawson, Jeremy M.; Thompson, Laurence K.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2018
Journal volume	47
Journal issue	8
Pages of publication	2511 - 2521
a	13.099 ± 0.003 Å
b	13.734 ± 0.003 Å
c	15.973 ± 0.007 Å
α	90°
β	106.33 ± 0.03°
γ	90°
Cell volume	2757.6 ± 1.5 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	I 1 2/a 1
Hall space group symbol	-I 2ya
Residual factor for all reflections	0.0537
Residual factor for significantly intense reflections	0.0365
Weighted residual factors for significantly intense reflections	0.1009
Weighted residual factors for all reflections included in the refinement	0.1162
Goodness-of-fit parameter for all reflections included in the refinement	1.006
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
229404 (current)	2019-11-17	cif/ Updating files of 7045131, 7045132, 7045133, 7045134, 7045135 Original log message: Adding full bibliography for 7045131--7045135.cif.	7045134.cif
204474	2017-12-22	cif/ Adding structures of 7045131, 7045132, 7045133, 7045134, 7045135 via cif-deposit CGI script.	7045134.cif