Crystallography Open Database

Information card for entry 7058042

Preview

Coordinates	7058042.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H42 Cu3 I6 N6 O8
Calculated formula	C38 H42 Cu3 I6 N6 O8
Title of publication	Synthesis of a new acetate bridged Cu(ii) building block generated 1D polymer and studies on structural, magnetic, antibacterial and anticancer properties
Authors of publication	Pathak, Sayantan; Ghosh, Mithun K.; Mandal, Manab; Mandal, Vivekananda; Bhattacharyya, Arnab; Ghorai, Tanmay K.
Journal of publication	New Journal of Chemistry
Year of publication	2019
Journal volume	43
Journal issue	4
Pages of publication	2019
a	14.504 ± 0.004 Å
b	24.027 ± 0.006 Å
c	10.129 ± 0.003 Å
α	90°
β	133.17 ± 0.002°
γ	90°
Cell volume	2574.4 ± 1.2 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
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	0.079
Residual factor for significantly intense reflections	0.046
Weighted residual factors for significantly intense reflections	0.1364
Weighted residual factors for all reflections included in the refinement	0.1592
Goodness-of-fit parameter for all reflections included in the refinement	1.057
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
224802 (current)	2019-11-08	cif/ Updating files of 7058042 Original log message: Adding full bibliography for 7058042.cif.	7058042.cif
212570	2018-12-13	cif/ Adding structures of 7058042 via cif-deposit CGI script.	7058042.cif