Crystallography Open Database

Information card for entry 7028546

Preview

Coordinates	7028546.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H42 Cu2 Mn N4 O8
Calculated formula	C48 H42 Cu2 Mn N4 O8
Title of publication	Trinuclear heterometallic Cu(II)-Mn(II) complexes of a salen type Schiff base ligand: anion dependent variation of phenoxido bridging angles and magnetic coupling.
Authors of publication	Seth, Piya; Ghosh, Soumavo; Figuerola, Albert; Ghosh, Asutosh
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2014
Journal volume	43
Journal issue	3
Pages of publication	990 - 998
a	24.025 ± 0.003 Å
b	9.4785 ± 0.0011 Å
c	18.776 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	4275.7 ± 0.9 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	33
Hermann-Mauguin space group symbol	P n a 21
Hall space group symbol	P 2c -2n
Residual factor for all reflections	0.0303
Residual factor for significantly intense reflections	0.026
Weighted residual factors for significantly intense reflections	0.0607
Weighted residual factors for all reflections included in the refinement	0.0627
Goodness-of-fit parameter for all reflections included in the refinement	1.03
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179991 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/85.	7028546.cif
105360	2014-03-12	cif/ Adding structures of 7028546, 7028547, 7028548, 7028549, 7028550 via cif-deposit CGI script.	7028546.cif