Crystallography Open Database

Information card for entry 4338987

Preview

Coordinates	4338987.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H15 N3 O10 P2 W2
Calculated formula	C16 H15 N3 O10 P2 W2
Title of publication	Comparisons of phosphorus ligation properties in P(CH2NR)3P.
Authors of publication	Thirupathi, Natesan; Stricklen, Phillip M.; Liu, Xiaodong; Oshel, Reed; Guzei, Ilia; Ellern, Arkady; Verkade, John G.
Journal of publication	Inorganic chemistry
Year of publication	2007
Journal volume	46
Journal issue	22
Pages of publication	9351 - 9363
a	14.4369 ± 0.0008 Å
b	12.5461 ± 0.0007 Å
c	13.4794 ± 0.0007 Å
α	90°
β	90°
γ	90°
Cell volume	2441.5 ± 0.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	29
Hermann-Mauguin space group symbol	P c a 21
Hall space group symbol	P 2c -2ac
Residual factor for all reflections	0.0253
Residual factor for significantly intense reflections	0.0226
Weighted residual factors for significantly intense reflections	0.056
Weighted residual factors for all reflections included in the refinement	0.0569
Goodness-of-fit parameter for all reflections included in the refinement	1.053
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
179492 (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 4/33/89.	4338987.cif
117045	2014-06-14	cif/ Adding structures of 4338987 via cif-deposit CGI script.	4338987.cif