Crystallography Open Database

Information card for entry 7201517

7201516 << 7201517 >> 7201518

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Coordinates	7201517.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H17 Cl Cu F N3 O7
Calculated formula	C22 H17 Cl Cu F N3 O7
Title of publication	Controlling the geometry of Cu(ii) tectons to build one-dimensional hydrogen bonded chains
Authors of publication	Martínez-Vargas, Sergio; Hernández-Ortega, Simón; Toscano, Rubén A.; Salazar-Mendoza, Domingo; Valdés-Martínez, Jesús
Journal of publication	CrystEngComm
Year of publication	2008
Journal volume	10
Journal issue	1
Pages of publication	86
a	7.464 ± 0.0005 Å
b	11.7638 ± 0.0008 Å
c	13.5851 ± 0.0009 Å
α	81.132 ± 0.001°
β	79.124 ± 0.001°
γ	73.027 ± 0.001°
Cell volume	1114.14 ± 0.13 Å³
Cell temperature	291 ± 2 K
Ambient diffraction temperature	291 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.044
Residual factor for significantly intense reflections	0.0358
Weighted residual factors for significantly intense reflections	0.0811
Weighted residual factors for all reflections included in the refinement	0.0835
Goodness-of-fit parameter for all reflections included in the refinement	0.951
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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