Crystallography Open Database

Information card for entry 7112191

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Coordinates	7112191.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C41 H30 Cl2 N2 O2
Calculated formula	C41 H28 Cl2 N2 O2
Title of publication	Preparation and structure of acenaphthylene-1,2-diyldi(9-acridine) derivatives with a long C[double bond, length as m-dash]C bond
Authors of publication	Takashi Takeda; Yasuto Uchimura; Hidetoshi Kawai; Ryo Katoono; Kenshu Fujiwara; Takanori Suzuki
Journal of publication	Chem.Commun.
Year of publication	2014
Journal volume	50
Pages of publication	3924
a	33.637 ± 0.017 Å
b	11.993 ± 0.006 Å
c	15.904 ± 0.008 Å
α	90°
β	97.925 ± 0.009°
γ	90°
Cell volume	6355 ± 6 Å³
Cell temperature	153 K
Ambient diffraction temperature	153 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for significantly intense reflections	0.0759
Weighted residual factors for all reflections included in the refinement	0.1462
Goodness-of-fit parameter for all reflections included in the refinement	1.202
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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