Crystallography Open Database

Information card for entry 7702696

Preview

Coordinates	7702696.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H38 Cu3 N4 O10
Calculated formula	C36 H38 Cu3 N4 O10
Title of publication	Magnetic properties of a bishelical [4 + 4 + 4] trinuclear copper(ii) complex
Authors of publication	Sanmartín, Jesús; Bermejo, Manuel R.; García-Deibe, Ana M.; Nascimento, Otaciro R.; Lezama, Luis; Rojo, Teófilo
Journal of publication	Journal of the Chemical Society, Dalton Transactions
Year of publication	2002
Journal issue	6
Pages of publication	1030
a	17.171 ± 0.003 Å
b	13.918 ± 0.003 Å
c	15.373 ± 0.003 Å
α	90°
β	110.026 ± 0.005°
γ	90°
Cell volume	3451.8 ± 1.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
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	0.1019
Residual factor for significantly intense reflections	0.0397
Weighted residual factors for significantly intense reflections	0.0928
Weighted residual factors for all reflections included in the refinement	0.1188
Goodness-of-fit parameter for all reflections included in the refinement	1.008
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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