Crystallography Open Database

Information card for entry 4333896

Preview

Coordinates	4333896.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Au O P2 Pr2
Calculated formula	Au O P2 Pr2
Title of publication	Phosphide Oxides RE2AuP2O (RE= La, Ce, Pr, Nd): Synthesis, Structure, Chemical Bonding, Magnetism, and 31P and 139La Solid State NMR
Authors of publication	Timo Bartsch; Thomas Wiegand; Jinjun Ren; Hellmut Eckert; Dirk Johrendt; Oliver Niehaus; Matthias Eul; Rainer Pöttgen
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	2094 - 2102
a	15.036 ± 0.004 Å
b	4.2277 ± 0.0008 Å
c	9.93 ± 0.002 Å
α	90°
β	130.88 ± 0.02°
γ	90°
Cell volume	477.3 ± 0.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	12
Hermann-Mauguin space group symbol	C 1 2/m 1
Hall space group symbol	-C 2y
Residual factor for all reflections	0.05
Residual factor for significantly intense reflections	0.0257
Weighted residual factors for significantly intense reflections	0.0372
Weighted residual factors for all reflections included in the refinement	0.0401
Goodness-of-fit parameter for all reflections included in the refinement	0.811
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
179441 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/38.	4333896.cif
99704	2014-02-03	cif/ Adding structures of 4333896 via cif-deposit CGI script.	4333896.cif