Crystallography Open Database

Information card for entry 7207835

7207834 << 7207835 >> 7207836

Preview

Coordinates	7207835.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	3
Formula	C21 H19 Cu N2 O9.5 P3
Calculated formula	C21 H18 Cu N2 O9.5 P3
Title of publication	New copper aryl phosphonates with auxiliary nitrogen ligands
Authors of publication	Zima, Vítězslav; Svoboda, Jan; Yang, Ya-Ching; Wang, Sue-Lein
Journal of publication	CrystEngComm
Year of publication	2012
Journal volume	14
Journal issue	10
Pages of publication	3469
a	10.1238 ± 0.0008 Å
b	10.4815 ± 0.0009 Å
c	13.143 ± 0.0011 Å
α	69.569 ± 0.001°
β	75.034 ± 0.001°
γ	63.557 ± 0.001°
Cell volume	1161.36 ± 0.17 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0385
Residual factor for significantly intense reflections	0.0342
Weighted residual factors for significantly intense reflections	0.0955
Weighted residual factors for all reflections included in the refinement	0.0988
Goodness-of-fit parameter for all reflections included in the refinement	1.073
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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