Crystallography Open Database

Information card for entry 4341819

Preview

Coordinates	4341819.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C49 H42 Cl2 N2 P6
Calculated formula	C49 H42 Cl2 N2 P6
Title of publication	Low-Valent Chemistry: An Alternative Approach to Phosphorus-Containing Oligomers.
Authors of publication	Kosnik, Stephanie C.; Farrar, Gregory J.; Norton, Erin L.; Cooper, Benjamin F. T.; Ellis, Bobby D.; Macdonald, Charles L. B.
Journal of publication	Inorganic chemistry
Year of publication	2014
Pages of publication	141201074418004
a	12.153 ± 0.002 Å
b	9.3574 ± 0.0016 Å
c	20.114 ± 0.003 Å
α	90°
β	90.115 ± 0.002°
γ	90°
Cell volume	2287.4 ± 0.6 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/n 1
Hall space group symbol	-P 2yac
Residual factor for all reflections	0.0434
Residual factor for significantly intense reflections	0.0392
Weighted residual factors for significantly intense reflections	0.095
Weighted residual factors for all reflections included in the refinement	0.0978
Goodness-of-fit parameter for all reflections included in the refinement	1.083
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
179521 (current)	2016-03-24	cif/4/34/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/34/18.	4341819.cif
128230	2014-12-06	cif/ Adding structures of 4341819 via cif-deposit CGI script.	4341819.cif