Crystallography Open Database

Information card for entry 7034059

Preview

Coordinates	7034059.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C102 H115 Dy2 Mn6 N18 O42.5
Calculated formula	C102 H115 Dy2 Mn6 N18 O42.5
Title of publication	A family of [Mn(III)6Ln(III)2] rod-like clusters.
Authors of publication	Tziotzi, Thomais G.; Kalofolias, Dimitris A.; Tzimopoulos, Demetrios I.; Siczek, Milosz; Lis, Tadeusz; Inglis, Ross; Milios, Constantinos J.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2015
Journal volume	44
Journal issue	13
Pages of publication	6082 - 6088
a	13.533 ± 0.003 Å
b	14.266 ± 0.003 Å
c	16.867 ± 0.004 Å
α	91.18 ± 0.02°
β	108.18 ± 0.02°
γ	111.57 ± 0.02°
Cell volume	2843.2 ± 1.3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 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	0.066
Residual factor for significantly intense reflections	0.0456
Weighted residual factors for significantly intense reflections	0.0997
Weighted residual factors for all reflections included in the refinement	0.11
Goodness-of-fit parameter for all reflections included in the refinement	1.037
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
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7034059.cif
134939	2015-04-06	cif/ Updating files of 7034059, 7034060 Original log message: Adding full bibliography for 7034059--7034060.cif.	7034059.cif
131907	2015-02-17	cif/ Adding structures of 7034059, 7034060 via cif-deposit CGI script.	7034059.cif