Crystallography Open Database

Information card for entry 7200250

7200249 << 7200250 >> 7200251

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Coordinates	7200250.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C17 H11 F3 N3
Calculated formula	C17 H11 F3 N3
Title of publication	Controlling the self assembly of arene functionalised 2-aminopyrimidines by arene-perfluoroarene interaction and by silver(I) complex formation
Authors of publication	Stoll, Ion; Brodbeck, Ralf; Neumann, Beate; Stammler, Hans-Georg; Mattay, Jochen
Journal of publication	CrystEngComm
Year of publication	2009
Journal volume	11
Journal issue	2
Pages of publication	306
a	14.7028 ± 0.0006 Å
b	7.3888 ± 0.0004 Å
c	13.7709 ± 0.0005 Å
α	90°
β	110.236 ± 0.003°
γ	90°
Cell volume	1403.68 ± 0.11 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 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	0.0609
Residual factor for significantly intense reflections	0.0459
Weighted residual factors for significantly intense reflections	0.1214
Weighted residual factors for all reflections included in the refinement	0.1319
Goodness-of-fit parameter for all reflections included in the refinement	1.039
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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