Crystallography Open Database

Information card for entry 2227772

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Structure parameters

Chemical name	4-Bromo-<i>N</i>-[4-(diethylamino)benzylidene]aniline
Formula	C17 H19 Br N2
Calculated formula	C17 H19 Br N2
SMILES	CCN(c1ccc(cc1)/C=N/c1ccc(cc1)Br)CC
Title of publication	4-Bromo-<i>N</i>-[4-(diethylamino)benzylidene]aniline
Authors of publication	Li, Xiao-Fang
Journal of publication	Acta Crystallographica Section E
Year of publication	2010
Journal volume	66
Journal issue	9
Pages of publication	o2417
a	10.1863 ± 0.0011 Å
b	12.3527 ± 0.0013 Å
c	14.34 ± 0.0015 Å
α	112.936 ± 0.002°
β	92.986 ± 0.001°
γ	104.305 ± 0.001°
Cell volume	1587.8 ± 0.3 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 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 all reflections	0.1114
Residual factor for significantly intense reflections	0.0479
Weighted residual factors for significantly intense reflections	0.1034
Weighted residual factors for all reflections included in the refinement	0.1149
Goodness-of-fit parameter for all reflections included in the refinement	1.016
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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