Crystallography Open Database

Information card for entry 7233823

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Coordinates	7233823.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C17 H20 N2 O3
Calculated formula	C17 H20 N2 O3
Title of publication	Interacting networks of purely organic spin-1/2 dimers
Authors of publication	Yulia B. Borozdina; Evgeny Mostovich; Volker Enkelmann; Bernd Wolf; Pham T. Cong; Ulrich Tutsch; Michael Lang; Martin Baumgarten
Journal of publication	Journal of Materials Chemistry C
Year of publication	2014
Journal volume	2
Pages of publication	6618 - 6629
a	13.045 ± 0.0005 Å
b	8.447 ± 0.0004 Å
c	13.703 ± 0.0005 Å
α	90°
β	91.593 ± 0.0012°
γ	90°
Cell volume	1509.37 ± 0.11 Å³
Cell temperature	293 K
Ambient diffraction temperature	293 K
Number of distinct elements	4
Space group number	7
Hermann-Mauguin space group symbol	P 1 n 1
Hall space group symbol	P -2yac
Residual factor for all reflections	0.2194
Residual factor for significantly intense reflections	0.0941
Weighted residual factors for all reflections	0.2797
Weighted residual factors for significantly intense reflections	0.0942
Weighted residual factors for all reflections included in the refinement	0.0942
Goodness-of-fit parameter for all reflections included in the refinement	5.6334
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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