Crystallography Open Database

Information card for entry 7219433

7219432 << 7219433 >> 7219434

Preview

Coordinates	7219433.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Coordination Polymer
Formula	C38 H28 Cu2 N4 O8 S
Calculated formula	C38 H28 Cu2 N4 O8 S
Title of publication	Coordination polymers based on copper carboxylates and angular 2,5-bis(imidazol-1-yl)thiophene (thim2) ligand: sequential structural transformations
Authors of publication	Singh, Namita; Vishnoi, Pratap; Anantharaman, Ganapathi
Journal of publication	CrystEngComm
Year of publication	2015
Journal volume	17
Journal issue	10
Pages of publication	2153
a	10.07 ± 0.005 Å
b	10.681 ± 0.006 Å
c	18.871 ± 0.012 Å
α	85.22 ± 0.02°
β	74.62 ± 0.02°
γ	71.56 ± 0.02°
Cell volume	1856.5 ± 1.8 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 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	0.1053
Residual factor for significantly intense reflections	0.0948
Weighted residual factors for significantly intense reflections	0.1834
Weighted residual factors for all reflections included in the refinement	0.1894
Goodness-of-fit parameter for all reflections included in the refinement	1.187
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
180525 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/94.	7219433.cif
133179	2015-03-06	cif/ Updating files of 7219431, 7219432, 7219433, 7219434 Original log message: Adding full bibliography for 7219431--7219434.cif.	7219433.cif
130217	2015-01-30	cif/ Adding structures of 7219431, 7219432, 7219433, 7219434 via cif-deposit CGI script.	7219433.cif