Crystallography Open Database

Information card for entry 4502662

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Coordinates	4502662.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C46 H34 Cl2 Gd N11 O11
Calculated formula	C46 H34 Cl2 Gd N11 O11
Title of publication	Porphyrin Framework Solids. Hybrid Supramolecular Assembly Modes of Tetrapyridylporphyrin and Aqua Nitrates of Lanthanoid Ions
Authors of publication	Lipstman, Sophia; Goldberg, Israel
Journal of publication	Crystal Growth & Design
Year of publication	2010
Journal volume	10
Journal issue	4
Pages of publication	1823
a	12.84 ± 0.0003 Å
b	30.695 ± 0.0009 Å
c	30.1003 ± 0.0008 Å
α	90°
β	101.55 ± 0.0012°
γ	90°
Cell volume	11623 ± 0.5 Å³
Cell temperature	110 ± 2 K
Ambient diffraction temperature	110 ± 2 K
Number of distinct elements	6
Space group number	12
Hermann-Mauguin space group symbol	C 1 2/m 1
Hall space group symbol	-C 2y
Residual factor for all reflections	0.0777
Residual factor for significantly intense reflections	0.0525
Weighted residual factors for significantly intense reflections	0.1158
Weighted residual factors for all reflections included in the refinement	0.1225
Goodness-of-fit parameter for all reflections included in the refinement	1.014
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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