Crystallography Open Database

Information card for entry 7036078

Preview

Coordinates	7036078.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H32 Er2 N6 O14 S3
Calculated formula	C48 H28 Er2 N6 O14 S3
Title of publication	Controlling dimensionality via a dual ligand strategy in Ln-thiophene-2,5-dicarboxylic acid-terpyridine coordination polymers.
Authors of publication	Carter, Korey P.; Zulato, Cecília H F; Rodrigues, Emille M.; Pope, Simon J. A.; Sigoli, Fernando A.; Cahill, Christopher L.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2015
Journal volume	44
Journal issue	36
Pages of publication	15843 - 15854
a	11.2143 ± 0.0006 Å
b	14.1588 ± 0.0007 Å
c	16.135 ± 0.0008 Å
α	109.045 ± 0.009°
β	94.266 ± 0.008°
γ	99.948 ± 0.009°
Cell volume	2361.6 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.0689
Residual factor for significantly intense reflections	0.047
Weighted residual factors for significantly intense reflections	0.0941
Weighted residual factors for all reflections included in the refinement	0.1007
Goodness-of-fit parameter for all reflections included in the refinement	1.044
Diffraction radiation probe	x-ray
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
161403 (current)	2015-10-09	cif/ Updating files of 7036071, 7036072, 7036073, 7036074, 7036075, 7036076, 7036077, 7036078, 7036079, 7036080, 7036081 Original log message: Adding full bibliography for 7036071--7036081.cif.	7036078.cif
152952	2015-08-06	cif/ Adding structures of 7036071, 7036072, 7036073, 7036074, 7036075, 7036076, 7036077, 7036078, 7036079, 7036080, 7036081 via cif-deposit CGI script.	7036078.cif