Crystallography Open Database

Information card for entry 7033305

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Coordinates	7033305.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C43 H34 Mn2 N2 O16
Calculated formula	C43 H32 Mn2 N2 O16
Title of publication	4-(4-carboxyphenoxy)phthalate-based coordination polymers and their application in sensing nitrobenzene.
Authors of publication	Wang, Yan-Ning; Zhang, Ping; Yu, Jie-Hui; Xu, Ji-Qing
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2015
Journal volume	44
Journal issue	4
Pages of publication	1655 - 1663
a	14.5688 ± 0.0007 Å
b	14.2833 ± 0.0009 Å
c	9.8497 ± 0.0006 Å
α	90°
β	100.28 ± 0.003°
γ	90°
Cell volume	2016.7 ± 0.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
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	0.0675
Residual factor for significantly intense reflections	0.0605
Weighted residual factors for significantly intense reflections	0.1666
Weighted residual factors for all reflections included in the refinement	0.1746
Goodness-of-fit parameter for all reflections included in the refinement	1.048
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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