Crystallography Open Database

Information card for entry 7157000

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Coordinates	7157000.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H26 N2 S
Calculated formula	C24 H26 N2 S
Title of publication	Dynamic optical activity induction in the N-alkyl-N'-trityl ureas and thioureas.
Authors of publication	Prusinowska, Natalia; Czapik, Agnieszka; Wojciechowska, Martika; Kwit, Marcin
Journal of publication	Organic & biomolecular chemistry
Year of publication	2019
Journal volume	17
Journal issue	33
Pages of publication	7782 - 7793
a	11.1159 ± 0.0001 Å
b	13.1734 ± 0.0001 Å
c	28.2695 ± 0.0003 Å
α	90°
β	96.402 ± 0.001°
γ	90°
Cell volume	4113.81 ± 0.07 Å³
Cell temperature	130 ± 2 K
Ambient diffraction temperature	130 ± 2 K
Number of distinct elements	4
Space group number	5
Hermann-Mauguin space group symbol	C 1 2 1
Hall space group symbol	C 2y
Residual factor for all reflections	0.0254
Residual factor for significantly intense reflections	0.0253
Weighted residual factors for significantly intense reflections	0.0677
Weighted residual factors for all reflections included in the refinement	0.0678
Goodness-of-fit parameter for all reflections included in the refinement	1.038
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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