Crystallography Open Database

Information card for entry 7206039

7206038 << 7206039 >> 7206040

Preview

Coordinates	7206039.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H20 B2 N4
Calculated formula	C24 H20 B2 N4
SMILES	N1c2cc(ccc2NB1c1ccccc1)c1cc2NB(Nc2cc1)c1ccccc1
Title of publication	Organic field-effect transistors based on novel organic semiconductors containing diazaboroles
Authors of publication	Kojima, Takahiro; Kumaki, Daisuke; Nishida, Jun-ichi; Tokito, Shizuo; Yamashita, Yoshiro
Journal of publication	Journal of Materials Chemistry
Year of publication	2011
Journal volume	21
Journal issue	18
Pages of publication	6607
a	9.396 ± 0.0007 Å
b	9.7337 ± 0.0007 Å
c	22.0591 ± 0.0015 Å
α	78.68 ± 0.002°
β	78.5522 ± 0.0018°
γ	75.835 ± 0.002°
Cell volume	1893.9 ± 0.2 Å³
Cell temperature	93.1 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for significantly intense reflections	0.0685
Weighted residual factors for all reflections included in the refinement	0.208
Goodness-of-fit parameter for all reflections included in the refinement	0.999
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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