Crystallography Open Database

Information card for entry 7224335

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Coordinates	7224335.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C33 H33 N5 O5
Calculated formula	C33 H33 N5 O5
Title of publication	Conformational properties and folding analysis of a series of seven oligoamide foldamers
Authors of publication	Suhonen, Aku; Kortelainen, Minna; Nauha, Elisa; Yliniemelä-Sipari, Sanna; Pihko, Petri M.; Nissinen, Maija
Journal of publication	CrystEngComm
Year of publication	2016
Journal volume	18
Journal issue	11
Pages of publication	2005
a	9.6881 ± 0.0006 Å
b	10.6294 ± 0.0007 Å
c	15.8346 ± 0.0009 Å
α	105.487 ± 0.005°
β	103.244 ± 0.005°
γ	102.241 ± 0.005°
Cell volume	1463.32 ± 0.17 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 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	0.0937
Residual factor for significantly intense reflections	0.058
Weighted residual factors for significantly intense reflections	0.0991
Weighted residual factors for all reflections included in the refinement	0.1136
Goodness-of-fit parameter for all reflections included in the refinement	1.037
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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