Crystallography Open Database

Information card for entry 7057791

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Coordinates	7057791.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	(S,E)-2-(((1-phenylethyl)imino)methyl)phenol
Formula	C15 H15 N O
Calculated formula	C15 H15 N O
Title of publication	Aggregation-induced emission enhancement of chiral boranils
Authors of publication	Vaz, Patrícia A. A. M.; Rocha, João; Silva, Artur M. S.; Guieu, Samuel
Journal of publication	New Journal of Chemistry
Year of publication	2018
Journal volume	42
Journal issue	22
Pages of publication	18166
a	18.227 ± 0.018 Å
b	5.852 ± 0.004 Å
c	14.53 ± 0.02 Å
α	90°
β	128.3 ± 0.09°
γ	90°
Cell volume	1216 ± 3 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	4
Space group number	5
Hermann-Mauguin space group symbol	C 1 2 1
Hall space group symbol	C 2y
Residual factor for all reflections	0.0585
Residual factor for significantly intense reflections	0.0453
Weighted residual factors for significantly intense reflections	0.1013
Weighted residual factors for all reflections included in the refinement	0.1118
Goodness-of-fit parameter for all reflections included in the refinement	1.125
Diffraction radiation wavelength	0.71076 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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