Crystallography Open Database

Information card for entry 7055007

Preview

Coordinates	7055007.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27 H31 Er O11
Calculated formula	C27 H31 Er O11
Title of publication	Rare earth 3-(4′-hydroxyphenyl)propionate complexes
Authors of publication	Deacon, Glen B.; Junk, Peter C.; Lee, Winnie W.; Forsyth, Maria; Wang, Jun
Journal of publication	New J. Chem.
Year of publication	2015
Journal volume	39
Journal issue	10
Pages of publication	7688
a	24.425 ± 0.005 Å
b	5.3513 ± 0.0011 Å
c	22.945 ± 0.005 Å
α	90°
β	90°
γ	90°
Cell volume	2999 ± 1.1 Å³
Cell temperature	123 ± 1 K
Ambient diffraction temperature	123.15 K
Number of distinct elements	4
Space group number	33
Hermann-Mauguin space group symbol	P n a 21
Hall space group symbol	P 2c -2n
Residual factor for all reflections	0.1041
Residual factor for significantly intense reflections	0.0627
Weighted residual factors for significantly intense reflections	0.1225
Weighted residual factors for all reflections included in the refinement	0.1337
Goodness-of-fit parameter for all reflections included in the refinement	1.042
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
162018 (current)	2015-10-09	cif/ Updating files of 7055006, 7055007, 7055008, 7055009, 7055010, 7055011 Original log message: Adding full bibliography for 7055006--7055011.cif.	7055007.cif
152460	2015-07-23	cif/ Adding structures of 7055006, 7055007, 7055008, 7055009, 7055010, 7055011 via cif-deposit CGI script.	7055007.cif