Crystallography Open Database

Information card for entry 7208976

7208975 << 7208976 >> 7208977

Preview

Coordinates	7208976.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C11 H13 Cu N3 O7 S
Calculated formula	C11 H13 Cu N3 O7 S
Title of publication	Metal dependent dimensionality in sulfate coordination polymers containing 3-pyridylisonicotinamide
Authors of publication	Lucas, Jacqueline S.; Uebler, Jacob W.; LaDuca, Robert L.
Journal of publication	CrystEngComm
Year of publication	2013
Journal volume	15
Journal issue	5
Pages of publication	860
a	24.075 ± 0.007 Å
b	9.496 ± 0.003 Å
c	14.226 ± 0.004 Å
α	90°
β	122.425 ± 0.004°
γ	90°
Cell volume	2745.2 ± 1.4 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0482
Residual factor for significantly intense reflections	0.0412
Weighted residual factors for significantly intense reflections	0.1081
Weighted residual factors for all reflections included in the refinement	0.1152
Goodness-of-fit parameter for all reflections included in the refinement	1.051
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
180420 (current)	2016-03-26	cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/89.	7208976.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7208976.cif
73551	2013-02-20	cif/ Adding structures of 7208975, 7208976, 7208977 via cif-deposit CGI script.	7208976.cif