Crystallography Open Database

Information card for entry 4506894

Preview

Coordinates	4506894.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C33 H55 N3 O3
Calculated formula	C33 H55 N3 O3
Title of publication	A Chiral Nanosheet Connected by Amide Hydrogen Bonds
Authors of publication	Hou, Xiaodong; Schober, Matthew; Chu, Qianli
Journal of publication	Crystal Growth & Design
Year of publication	2012
Journal volume	12
Journal issue	11
Pages of publication	5159
a	11.9029 ± 0.0003 Å
b	7.65 ± 0.0002 Å
c	18.0677 ± 0.0005 Å
α	90°
β	97.23 ± 0.002°
γ	90°
Cell volume	1632.11 ± 0.07 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 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	0.0839
Residual factor for significantly intense reflections	0.0561
Weighted residual factors for significantly intense reflections	0.1366
Weighted residual factors for all reflections included in the refinement	0.1647
Goodness-of-fit parameter for all reflections included in the refinement	1.091
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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