Crystallography Open Database

Information card for entry 7109905

Preview

Coordinates	7109905.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C140 H158 Cl N9 O6
Calculated formula	C140 H158 Cl N9 O6
Title of publication	A chiral indolocarbazole foldamer displaying strong circular dichroism responsive to anion binding
Authors of publication	Dan A Kim; Philjae Kang; Moon-Gun Choi; Kyu-Sung Jeong
Journal of publication	Chem.Commun.
Year of publication	2013
Journal volume	49
Pages of publication	9743
a	37.1603 ± 0.0008 Å
b	11.1559 ± 0.0003 Å
c	15.1723 ± 0.0003 Å
α	90°
β	90°
γ	90°
Cell volume	6289.8 ± 0.2 Å³
Cell temperature	170 K
Ambient diffraction temperature	170 K
Number of distinct elements	5
Space group number	18
Hermann-Mauguin space group symbol	P 21 21 2
Hall space group symbol	P 2 2ab
Residual factor for all reflections	0.0906
Residual factor for significantly intense reflections	0.0617
Weighted residual factors for significantly intense reflections	0.1587
Weighted residual factors for all reflections included in the refinement	0.1816
Goodness-of-fit parameter for all reflections included in the refinement	1.063
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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