Crystallography Open Database

Information card for entry 2012421

2012420 << 2012421 >> 2012422

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Structure parameters

Chemical name	4-[3-(2-bromophenyl)prop-2-enoyl]phenyl methacrylate
Formula	C19 H15 Br O3
Calculated formula	C19 H15 Br O3
SMILES	Brc1ccccc1/C=C/C(=O)c1ccc(OC(=O)C(=C)C)cc1
Title of publication	4-[3-(3,4-Dimethoxyphenyl)prop-2-enoyl]phenyl methacrylate and 4-[3-(2-bromophenyl)prop-2-enoyl]phenyl methacrylate
Authors of publication	Jeyabharathi, A.; Ponnuswamy, M. N.; Nanjundan, S.; Fun, Hoong-Kun; Suchada Chantrapromma; Usman, Anwar; Razak, Ibrahim Abdul
Journal of publication	Acta Crystallographica Section C
Year of publication	2002
Journal volume	58
Journal issue	1
Pages of publication	o26 - o28
a	7.5272 ± 0.0003 Å
b	10.194 ± 0.0004 Å
c	11.578 ± 0.0004 Å
α	96.227 ± 0.001°
β	98.428 ± 0.001°
γ	108.763 ± 0.001°
Cell volume	820.55 ± 0.05 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	0.0629
Residual factor for significantly intense reflections	0.056
Weighted residual factors for significantly intense reflections	0.1414
Weighted residual factors for all reflections included in the refinement	0.1455
Goodness-of-fit parameter for all reflections included in the refinement	0.992
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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