Crystallography Open Database

Information card for entry 7702210

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Coordinates	7702210.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H50 N6
Calculated formula	C40 H50 N6
Title of publication	Dinuclear tethered pyridine, diimine complexes.
Authors of publication	Dammann, Wiebke; Buban, Tabea; Schiller, Carl; Burger, Peter
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2018
Journal volume	47
Journal issue	35
Pages of publication	12105 - 12117
a	12.4198 ± 0.0002 Å
b	11.2441 ± 0.0001 Å
c	25.615 ± 0.0003 Å
α	90°
β	102.088 ± 0.001°
γ	90°
Cell volume	3497.81 ± 0.08 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 K
Number of distinct elements	3
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0413
Residual factor for significantly intense reflections	0.0377
Weighted residual factors for significantly intense reflections	0.1003
Weighted residual factors for all reflections included in the refinement	0.1038
Goodness-of-fit parameter for all reflections included in the refinement	1.042
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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