Crystallography Open Database

Information card for entry 7105637

Preview

Coordinates	7105637.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C6 H18 Cl6 Ga N2 P5 Si3
Calculated formula	C6 H18 Cl6 Ga N2 P5 Si3
SMILES	C[Si](C)(C)N1P2(=[N+]([Si](C)(C)C)[Si]1(Cl)Cl)P1P3P2P13.Cl[Ga](Cl)(Cl)[Cl-]
Title of publication	Zwitterionic and cationic P<sub>5</sub>-Clusters from four membered phosphorus nitrogen metal heterocycles
Authors of publication	J.Weigand; M.Holthausen; C.Richter; A.Hepp
Journal of publication	Chem.Commun.
Year of publication	2010
Journal volume	46
Journal issue	37
Pages of publication	6921 - 6923
a	9.3085 ± 0.0006 Å
b	9.8158 ± 0.0007 Å
c	14.7125 ± 0.001 Å
α	87.568 ± 0.001°
β	80.732 ± 0.001°
γ	71.578 ± 0.001°
Cell volume	1258.7 ± 0.15 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153 ± 1 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0305
Residual factor for significantly intense reflections	0.0253
Weighted residual factors for significantly intense reflections	0.0623
Weighted residual factors for all reflections included in the refinement	0.065
Goodness-of-fit parameter for all reflections included in the refinement	1.039
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
180160 (current)	2016-03-26	cif/7/10/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/10/56.	7105637.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7105637.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7105637.cif
1721	2010-11-03	../uploads/cif-deposit/cod/cif Adding structures of 7105636, 7105637 via cif-deposit CGI script.	7105637.cif