Crystallography Open Database

Information card for entry 7208981

7208980 << 7208981 >> 7208982

Preview

Coordinates	7208981.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C54 H104 Cd7 N12 O50 P6
Calculated formula	C54 H60 Cd7 N12 O50 P6
Title of publication	Syntheses, crystal structures, thermal stability, magnetism and luminescence of four new metal phosphonates
Authors of publication	Fu, Ruibiao; Hu, Shengmin; Wu, Xintao
Journal of publication	CrystEngComm
Year of publication	2013
Journal volume	15
Journal issue	4
Pages of publication	802
a	22.891 ± 0.002 Å
b	22.891 ± 0.002 Å
c	13.1165 ± 0.0011 Å
α	90°
β	90°
γ	120°
Cell volume	5952.2 ± 0.9 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Residual factor for all reflections	0.0497
Residual factor for significantly intense reflections	0.0443
Weighted residual factors for significantly intense reflections	0.1088
Weighted residual factors for all reflections included in the refinement	0.1123
Goodness-of-fit parameter for all reflections included in the refinement	1.148
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.	7208981.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7208981.cif
73554	2013-02-20	cif/ Adding structures of 7208981, 7208982, 7208983 via cif-deposit CGI script.	7208981.cif