Crystallography Open Database

Information card for entry 7208977

7208976 << 7208977 >> 7208978

Preview

Coordinates	7208977.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C11 H11 Cd N3 O6 S
Calculated formula	C11 H11 Cd N3 O6 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	8.6706 ± 0.0008 Å
b	21.5919 ± 0.0019 Å
c	6.9169 ± 0.0006 Å
α	90°
β	90.171 ± 0.001°
γ	90°
Cell volume	1294.9 ± 0.2 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0402
Residual factor for significantly intense reflections	0.0302
Weighted residual factors for significantly intense reflections	0.0706
Weighted residual factors for all reflections included in the refinement	0.075
Goodness-of-fit parameter for all reflections included in the refinement	1.079
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.	7208977.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7208977.cif
73551	2013-02-20	cif/ Adding structures of 7208975, 7208976, 7208977 via cif-deposit CGI script.	7208977.cif