Crystallography Open Database

Information card for entry 7039108

Preview

Coordinates	7039108.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H58 Co2 N5 O24 Tb
Calculated formula	C28 H40 Co2 N5 O18 Tb
Title of publication	Heterometallic trinuclear {CoLn(III)} (Ln = Gd, Tb, Ho and Er) complexes in a bent geometry. Field-induced single-ion magnetic behavior of the Er(III) and Tb(III) analogues.
Authors of publication	Goura, Joydeb; Brambleby, Jamie; Topping, Craig V.; Goddard, Paul A.; Suriya Narayanan, Ramakirushnan; Bar, Arun Kumar; Chandrasekhar, Vadapalli
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2016
Journal volume	45
Journal issue	22
Pages of publication	9235 - 9249
a	25.196 ± 0.005 Å
b	11.877 ± 0.005 Å
c	16.58 ± 0.005 Å
α	90°
β	117.333 ± 0.005°
γ	90°
Cell volume	4408 ± 2 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
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	0.0915
Residual factor for significantly intense reflections	0.0601
Weighted residual factors for significantly intense reflections	0.1444
Weighted residual factors for all reflections included in the refinement	0.1873
Goodness-of-fit parameter for all reflections included in the refinement	1.14
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
185309 (current)	2016-08-07	cif/ Updating files of 7039107, 7039108, 7039109, 7039110 Original log message: Adding full bibliography for 7039107--7039110.cif.	7039108.cif
182345	2016-04-28	cif/ Adding structures of 7039107, 7039108, 7039109, 7039110 via cif-deposit CGI script.	7039108.cif