Crystallography Open Database

Information card for entry 7007707

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Coordinates	7007707.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C26 H44 Br5 N7 O2
Calculated formula	C26 H39 Br5 N7 O2
Title of publication	Coordination features of a terpyridine-containing polyamine receptor. Effect of protonation on the photophysical properties of the complexes.
Authors of publication	Bazzicalupi, Carla; Bencini, Andrea; Bianchi, Antonio; Borsari, Lucia; Danesi, Andrea; Giorgi, Claudia; Mariani, Palma; Pina, Fernando; Santarelli, Samuele; Valtancoli, Barbara
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2006
Journal issue	48
Pages of publication	5743 - 5752
a	7.645 ± 0.002 Å
b	15.062 ± 0.003 Å
c	16.524 ± 0.004 Å
α	75.695 ± 0.009°
β	77.65 ± 0.01°
γ	82.034 ± 0.009°
Cell volume	1793.7 ± 0.7 Å³
Cell temperature	298 K
Ambient diffraction temperature	298 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1105
Residual factor for significantly intense reflections	0.0606
Weighted residual factors for significantly intense reflections	0.1435
Weighted residual factors for all reflections included in the refinement	0.185
Goodness-of-fit parameter for all reflections included in the refinement	0.625
Diffraction radiation wavelength	1.5418 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179781 (current)	2016-03-25	cif/7/00/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/00/77.	7007707.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7007707.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7007707.cif
1504	2010-09-08	cif/7/ Adding data extracted from RSC 2005 and 2006 year publications.	7007707.cif