Crystallography Open Database

Information card for entry 7037535

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Coordinates	7037535.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C102 H104 Cu7 Gd2 N8 O26
Calculated formula	C102 H104 Cu7 Gd2 N8 O26
Title of publication	Solvothermal synthesis of enneanuclear [CuLn] clusters.
Authors of publication	Canaj, Angelos B.; Tzimopoulos, Demetrios I.; Otręba, Marta; Lis, Tadeusz; Inglis, Ross; Milios, Constantinos J.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2015
Journal volume	44
Journal issue	46
Pages of publication	19880 - 19885
a	11.991 ± 0.003 Å
b	14.52 ± 0.004 Å
c	16.537 ± 0.004 Å
α	68.4 ± 0.02°
β	69.42 ± 0.02°
γ	84.05 ± 0.02°
Cell volume	2505.1 ± 1.2 Å³
Cell temperature	170 ± 2 K
Ambient diffraction temperature	170 ± 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	0.0712
Residual factor for significantly intense reflections	0.0447
Weighted residual factors for significantly intense reflections	0.0991
Weighted residual factors for all reflections included in the refinement	0.1046
Goodness-of-fit parameter for all reflections included in the refinement	1.005
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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