Crystallography Open Database

Information card for entry 7219432

7219431 << 7219432 >> 7219433

Preview

Coordinates	7219432.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	coordination polymer
Formula	C24 H18 Cu N4 O4 S
Calculated formula	C24 H18 Cu N4 O4 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	9.927 ± 0.005 Å
b	9.945 ± 0.005 Å
c	11.752 ± 0.005 Å
α	94.242 ± 0.005°
β	104.517 ± 0.005°
γ	98.603 ± 0.005°
Cell volume	1103 ± 0.9 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 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	0.0856
Residual factor for significantly intense reflections	0.0574
Weighted residual factors for significantly intense reflections	0.1414
Weighted residual factors for all reflections included in the refinement	0.1978
Goodness-of-fit parameter for all reflections included in the refinement	1.057
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176432 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	7219432.cif
133179	2015-03-06	cif/ Updating files of 7219431, 7219432, 7219433, 7219434 Original log message: Adding full bibliography for 7219431--7219434.cif.	7219432.cif
130217	2015-01-30	cif/ Adding structures of 7219431, 7219432, 7219433, 7219434 via cif-deposit CGI script.	7219432.cif