Crystallography Open Database

Information card for entry 7202473

7202472 << 7202473 >> 7202474

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Structure parameters

Formula	C31 H30 N O
Calculated formula	C31 H30 N O
SMILES	C1(c2c(ccc(c2)c2ccccc2)[N](c2c1cc(cc2)c1ccccc1)=O)(CCC)CCC
Title of publication	Synthesis and through-bond spin interaction of stable 1,3-phenylene-linked polyradical carrying aminoxyls in the ?-conjugated main chain
Authors of publication	Oka, Hiroyuki; Kouno, Hiroshi; Tanaka, Hitoshi
Journal of publication	Journal of Materials Chemistry
Year of publication	2007
Journal volume	17
Journal issue	12
Pages of publication	1209
a	11.0586 ± 0.0006 Å
b	25.0054 ± 0.0011 Å
c	9.3633 ± 0.0007 Å
α	90°
β	108.299 ± 0.002°
γ	90°
Cell volume	2458.3 ± 0.3 Å³
Cell temperature	296 ± 2 K
Number of distinct elements	4
Space group number	9
Hermann-Mauguin space group symbol	C 1 c 1
Hall space group symbol	C -2yc
Residual factor for all reflections	0.0494
Residual factor for significantly intense reflections	0.0451
Weighted residual factors for significantly intense reflections	0.1087
Weighted residual factors for all reflections included in the refinement	0.1142
Goodness-of-fit parameter for all reflections included in the refinement	1.022
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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