Crystallography Open Database

Information card for entry 2311667

Preview

Coordinates	2311667.cif
Original IUCr paper	HTML

Structure parameters

Formula	C36 H42 Ce N7 O15 P2
Calculated formula	C36 H42 Ce N7 O15 P2
Title of publication	Phosphoramides bearing isoxazole derivative: spectroscopic and structural characterization, study of hydrogen-bonding interactions and two lanthanide complexes (LnIII = Ce and Eu).
Authors of publication	Gholivand, Khodayar; Molaei, Foroogh; Hosseini, Mahdieh
Journal of publication	Acta crystallographica Section B, Structural science, crystal engineering and materials
Year of publication	2015
Journal volume	71
Journal issue	Pt 2
Pages of publication	176 - 185
a	14.8817 ± 0.0005 Å
b	15.9332 ± 0.0005 Å
c	36.7289 ± 0.0012 Å
α	90°
β	96.133 ± 0.001°
γ	90°
Cell volume	8659.1 ± 0.5 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0793
Residual factor for significantly intense reflections	0.0455
Weighted residual factors for significantly intense reflections	0.0811
Weighted residual factors for all reflections included in the refinement	0.0904
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	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
246076 (current)	2019-12-26	cif/ Adding structures of 2311666, 2311667, 2311668 via cif-deposit CGI script.	2311667.cif