Crystallography Open Database

Information card for entry 7152087

7152086 << 7152087 >> 7152088

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Coordinates	7152087.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C25 H45 N O3
Calculated formula	C25 H45 N O3
Title of publication	Asymmetric synthesis and cytotoxic activity of isomeric phytosphingosine derivatives.
Authors of publication	Rives, Arnaud; Baudoin-Dehoux, Cécile; Saffon, Nathalie; Andrieu-Abadie, Nathalie; Génisson, Yves
Journal of publication	Organic & biomolecular chemistry
Year of publication	2011
Journal volume	9
Journal issue	23
Pages of publication	8163 - 8170
a	10.2997 ± 0.0005 Å
b	4.987 ± 0.0003 Å
c	24.6551 ± 0.0013 Å
α	90°
β	92.668 ± 0.004°
γ	90°
Cell volume	1265.03 ± 0.12 Å³
Cell temperature	193 ± 2 K
Ambient diffraction temperature	193 ± 2 K
Number of distinct elements	4
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0831
Residual factor for significantly intense reflections	0.0545
Weighted residual factors for significantly intense reflections	0.1405
Weighted residual factors for all reflections included in the refinement	0.1557
Goodness-of-fit parameter for all reflections included in the refinement	1.071
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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