Crystallography Open Database

Information card for entry 7205375

7205374 << 7205375 >> 7205376

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Coordinates	7205375.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C53 H54 N6 O13
Calculated formula	C53 H54 N6 O13
Title of publication	Coordination polymers of flexible tetracarboxylic acids with metal ions. I. Synthesis of CH2- and (CH2)2-spaced bis(oxy)isophthalic acid ligands, and structural characterization of their polymeric adducts with lanthanoid ions
Authors of publication	Karmakar, Anirban; Goldberg, Israel
Journal of publication	CrystEngComm
Year of publication	2011
Journal volume	13
Journal issue	1
Pages of publication	339
a	19.3767 ± 0.0003 Å
b	23.1849 ± 0.0007 Å
c	13.7787 ± 0.0003 Å
α	90°
β	126.742 ± 0.0013°
γ	90°
Cell volume	4960.3 ± 0.2 Å³
Cell temperature	110 ± 2 K
Ambient diffraction temperature	110 ± 2 K
Number of distinct elements	4
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.1289
Residual factor for significantly intense reflections	0.0742
Weighted residual factors for significantly intense reflections	0.14
Weighted residual factors for all reflections included in the refinement	0.1599
Goodness-of-fit parameter for all reflections included in the refinement	1.036
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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