Crystallography Open Database

Information card for entry 4135459

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Coordinates	4135459.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H24 N2 O14 Rb2
Calculated formula	C20 H24 N2 O14 Rb2
Title of publication	Crystal Lattice Design of H2O-Tolerant n-Type Semiconducting Dianionic Naphthalenediimide Derivatives
Authors of publication	Abe, Haruka; Kawasaki, Ayumi; Takeda, Takashi; Hoshino, Norihisa; Matsuda, Wakana; Seki, Shu; Akutagawa, Tomoyuki
Journal of publication	Journal of the American Chemical Society
Year of publication	2020
a	5.8795 ± 0.0003 Å
b	6.8242 ± 0.0004 Å
c	17.4352 ± 0.0009 Å
α	81.502 ± 0.006°
β	88.355 ± 0.006°
γ	63.886 ± 0.005°
Cell volume	620.72 ± 0.06 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0473
Residual factor for significantly intense reflections	0.0438
Weighted residual factors for significantly intense reflections	0.1121
Weighted residual factors for all reflections included in the refinement	0.1144
Goodness-of-fit parameter for all reflections included in the refinement	1.072
Diffraction radiation wavelength	1.54187 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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