Crystallography Open Database

Information card for entry 4111920

4111919 << 4111920 >> 4111921

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Coordinates	4111920.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C70.5 H76 N9 O10
Calculated formula	C70.5 H75.5 N9 O10
Title of publication	Chiral Induction in Quinoline-Derived Oligoamide Foldamers: Assignment of Helical Handedness and Role of Steric Effects
Authors of publication	Christel Dolain; Hua Jiang; Jean-Michel Léger; Philippe Guionneau; Ivan Huc
Journal of publication	Journal of the American Chemical Society
Year of publication	2005
Journal volume	127
Pages of publication	12943 - 12951
a	13.271 ± 0.001 Å
b	14.131 ± 0.001 Å
c	20.652 ± 0.001 Å
α	90.15 ± 0.01°
β	104.04 ± 0.01°
γ	117.1 ± 0.01°
Cell volume	3315.9 ± 0.5 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1357
Residual factor for significantly intense reflections	0.0837
Weighted residual factors for significantly intense reflections	0.2367
Weighted residual factors for all reflections included in the refinement	0.2883
Goodness-of-fit parameter for all reflections included in the refinement	1.034
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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