Crystallography Open Database

Information card for entry 7233491

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Coordinates	7233491.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H18 N2 O4
Calculated formula	C22 H18 N2 O4
SMILES	O=C1N(C(=O)c2c3c4c(C(=O)N(C(=O)c4cc2)C2CCC2)ccc13)C1CCC1
Title of publication	Correlation of mobility and molecular packing in organic transistors based on cycloalkyl naphthalene diimides
Authors of publication	Tomoyuki Kakinuma; Hirotaka Kojima; Minoru Ashizawa; Hidetoshi Matsumoto; Takehiko Mori
Journal of publication	Journal of Materials Chemistry C
Year of publication	2013
Journal volume	1
Pages of publication	5395 - 5401
a	27.567 ± 0.008 Å
b	9.156 ± 0.003 Å
c	13.752 ± 0.014 Å
α	90°
β	97.93 ± 0.05°
γ	90°
Cell volume	3438 ± 4 Å³
Cell temperature	298 K
Ambient diffraction temperature	298 K
Number of distinct elements	4
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	0.0509
Weighted residual factors for all reflections included in the refinement	0.1603
Goodness-of-fit parameter for all reflections included in the refinement	1.027
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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