Crystallography Open Database

Information card for entry 7032822

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Coordinates	7032822.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H26 N4 O13 Zn2
Calculated formula	C36 H26 N4 O13 Zn2
Title of publication	A luminescent 3D interpenetrating metal-organic framework for highly selective sensing of nitrobenzene.
Authors of publication	Singh, Divyendu; Nagaraja, C. M.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2014
Journal volume	43
Journal issue	48
Pages of publication	17912 - 17915
a	12.0348 ± 0.0004 Å
b	12.8584 ± 0.0004 Å
c	13.6481 ± 0.0004 Å
α	89.712 ± 0.002°
β	66.644 ± 0.001°
γ	75.338 ± 0.001°
Cell volume	1864.98 ± 0.1 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1067
Residual factor for significantly intense reflections	0.0541
Weighted residual factors for significantly intense reflections	0.1217
Weighted residual factors for all reflections included in the refinement	0.1494
Goodness-of-fit parameter for all reflections included in the refinement	1.033
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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