Crystallography Open Database

Information card for entry 7234007

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Coordinates	7234007.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C44 H38 I2 N8
Calculated formula	C46 H38 I2 N8
Title of publication	Supramolecular hierarchy among halogen and hydrogen bond donors in light-induced surface patterning
Authors of publication	Marco Saccone; Valentina Dichiarante; Alessandra Forni; Alexis Goulet-Hanssens; Gabriella Cavallo; Jaana Vapaavuori; Giancarlo Terraneo; Christopher J. Barrett; Giuseppe Resnati; Pierangelo Metrangolo; Arri Priimagi
Journal of publication	Journal of Materials Chemistry C
Year of publication	2015
Journal volume	3
Pages of publication	759 - 768
a	17.6158 ± 0.0015 Å
b	7.4356 ± 0.0008 Å
c	14.8281 ± 0.0015 Å
α	90°
β	98.184 ± 0.003°
γ	90°
Cell volume	1922.5 ± 0.3 Å³
Cell temperature	103 ± 2 K
Ambient diffraction temperature	103 ± 2 K
Number of distinct elements	4
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	0.0417
Residual factor for significantly intense reflections	0.0351
Weighted residual factors for significantly intense reflections	0.0721
Weighted residual factors for all reflections included in the refinement	0.0753
Goodness-of-fit parameter for all reflections included in the refinement	1.095
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
218589 (current)	2019-09-20	cif/ Adding structures of 7234006, 7234007 via cif-deposit CGI script.	7234007.cif