Crystallography Open Database

Information card for entry 7024271

Preview

Coordinates	7024271.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C53.75 H43.75 Cl4 Cu3 N6.25 O11.25
Calculated formula	C53.75 H38 Cl4 Cu3 N6.25 O11.25
Title of publication	Copper inverse-9-metallacrown-3 compounds interacting with DNA.
Authors of publication	Afrati, Tereza; Pantazaki, Anastasia A.; Dendrinou-Samara, Catherine; Raptopoulou, Catherine; Terzis, Aris; Kessissoglou, Dimitris P.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2010
Journal volume	39
Journal issue	3
Pages of publication	765 - 775
a	14.82 ± 0.01 Å
b	15.783 ± 0.008 Å
c	24.9 ± 0.01 Å
α	90.61 ± 0.02°
β	94.51 ± 0.03°
γ	104.34 ± 0.03°
Cell volume	5623 ± 5 Å³
Cell temperature	298 K
Ambient diffraction temperature	298 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	0.0929
Residual factor for significantly intense reflections	0.0589
Weighted residual factors for significantly intense reflections	0.1495
Weighted residual factors for all reflections included in the refinement	0.1756
Goodness-of-fit parameter for all reflections included in the refinement	1.054
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
179947 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/42.	7024271.cif
92335	2014-01-12	cif/ Adding structures of 7024271 via cif-deposit CGI script.	7024271.cif