Crystallography Open Database

Information card for entry 2204309

2204308 << 2204309 >> 2204310

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Structure parameters

Chemical name	Methyl 3-dimethylamino-2-{2-[2-(dimethylamino)-1-(3-phenyl-1,2,4-oxadiazol-5- yl)vinyloxy]phenyl}acrylate
Formula	C24 H26 N4 O4
Calculated formula	C24 H26 N4 O4
SMILES	o1nc(nc1C(=C\N(C)C)\Oc1ccccc1C(=C\N(C)C)/C(=O)OC)c1ccccc1
Title of publication	Methyl 3-dimethylamino-2-{2-[2-(dimethylamino)-1-(3-phenyl-1,2,4-oxadiazol-5-yl)vinyloxy]phenyl}acrylate
Authors of publication	Wang, Hai-Bo; Chen, Jia-Hui; Wang, Jin-Tang
Journal of publication	Acta Crystallographica Section E
Year of publication	2004
Journal volume	60
Journal issue	10
Pages of publication	o1709 - o1711
a	11.22 ± 0.002 Å
b	12.26 ± 0.003 Å
c	17.762 ± 0.004 Å
α	71.06 ± 0.03°
β	86.35 ± 0.03°
γ	85.19 ± 0.03°
Cell volume	2301.1 ± 1 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.1466
Residual factor for significantly intense reflections	0.073
Weighted residual factors for significantly intense reflections	0.218
Weighted residual factors for all reflections included in the refinement	0.2585
Goodness-of-fit parameter for all reflections included in the refinement	1.116
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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