Crystallography Open Database

Information card for entry 4502668

Preview

Coordinates	4502668.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C60 H48 Cl6 N11 O12 Yb
Calculated formula	C60 H48 Cl6 N11 O12 Yb
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	14.5139 ± 0.0002 Å
b	14.9753 ± 0.0002 Å
c	17.834 ± 0.0002 Å
α	65.5496 ± 0.0004°
β	89.3807 ± 0.0005°
γ	63.1472 ± 0.0005°
Cell volume	3073.17 ± 0.07 Å³
Cell temperature	110 ± 2 K
Ambient diffraction temperature	110 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0412
Residual factor for significantly intense reflections	0.035
Weighted residual factors for significantly intense reflections	0.0852
Weighted residual factors for all reflections included in the refinement	0.088
Goodness-of-fit parameter for all reflections included in the refinement	1.027
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179557 (current)	2016-03-24	cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/26.	4502668.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4502668.cif
36506	2012-03-01	../uploads/cif-deposit/cod/cif Adding structures of 4502661, 4502662, 4502663, 4502664, 4502665, 4502666, 4502667, 4502668, 4502669, 4502670 via cif-deposit CGI script.	4502668.cif