Crystallography Open Database

Information card for entry 7015989

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Coordinates	7015989.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H17 N3 O9 Zn
Calculated formula	C18 H17 N3 O9 Zn
Title of publication	A 2D homochiral inorganic-organic framework exhibiting a spin-flop transition.
Authors of publication	Li, Wei; Barton, Phillip T.; Burwood, Ryan P.; Cheetham, Anthony K.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2011
Journal volume	40
Journal issue	27
Pages of publication	7147 - 7152
a	10.8701 ± 0.0009 Å
b	8.4038 ± 0.0005 Å
c	11.3838 ± 0.001 Å
α	90°
β	112.816 ± 0.01°
γ	90°
Cell volume	958.54 ± 0.15 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	5
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0411
Residual factor for significantly intense reflections	0.038
Weighted residual factors for significantly intense reflections	0.1023
Weighted residual factors for all reflections included in the refinement	0.1033
Goodness-of-fit parameter for all reflections included in the refinement	1.065
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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