Crystallography Open Database

Information card for entry 8106458

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Coordinates	8106458.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C17 H12 N2 O3
Calculated formula	C17 H12 N2 O3
Title of publication	Crystal structure of (E)-3-((naphthalen-1-ylimino)methyl)-4-nitrophenol, C17H12N2O3
Authors of publication	Bülbül, Hakan; Köysal, Yavuz; Macit, Mustafa; Yaman, Rukiye; Dege, Necmi
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2017
Journal volume	232
Journal issue	1
Pages of publication	135 - 136
a	7.2641 ± 0.0005 Å
b	12.3968 ± 0.0006 Å
c	16.1786 ± 0.0013 Å
α	90°
β	108.2 ± 0.006°
γ	90°
Cell volume	1384.02 ± 0.17 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1635
Residual factor for significantly intense reflections	0.0905
Weighted residual factors for significantly intense reflections	0.1587
Weighted residual factors for all reflections included in the refinement	0.1928
Goodness-of-fit parameter for all reflections included in the refinement	1.034
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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