Crystallography Open Database

Information card for entry 4334083

Preview

Coordinates	4334083.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C88 H64 Eu6 N8 O34 S8
Calculated formula	C88 H52 Eu6 N8 O34 S8
Title of publication	Lanthanide-Porphyrin Hybrids: from Layered Structures to Metal-Organic Frameworks with Photophysical Properties
Authors of publication	Jan Demel; Pavel Kubát; Franck Millange; Jérôme Marrot; Ivana Císařová; Kamil Lang
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	2779 - 2786
a	45.95 ± 0.002 Å
b	9.1496 ± 0.0005 Å
c	31.3267 ± 0.0015 Å
α	90°
β	124.211 ± 0.001°
γ	90°
Cell volume	10891.6 ± 0.9 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	6
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	0.0668
Residual factor for significantly intense reflections	0.0452
Weighted residual factors for significantly intense reflections	0.1154
Weighted residual factors for all reflections included in the refinement	0.1283
Goodness-of-fit parameter for all reflections included in the refinement	1.163
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
179443 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/40.	4334083.cif
99893	2014-02-03	cif/ Adding structures of 4334083 via cif-deposit CGI script.	4334083.cif