Crystallography Open Database

Information card for entry 7053559

Preview

Coordinates	7053559.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C15 H25 Cl3 Ga P
Calculated formula	C15 H25 Cl3 Ga P
SMILES	C(C(C)(C)C)=[P](C12CC3CC(C1)CC(C2)C3)[Ga](Cl)(Cl)Cl
Title of publication	A Lewis acid-mediated synthesis of P-alkyl-substituted phosphaalkenes
Authors of publication	Bates, Joshua I.; Patrick, Brian O.; Gates, Derek P.
Journal of publication	New Journal of Chemistry
Year of publication	2010
Journal volume	34
Journal issue	8
Pages of publication	1660
a	10.5923 ± 0.0011 Å
b	15.9466 ± 0.0017 Å
c	11.3326 ± 0.0013 Å
α	90°
β	107.238 ± 0.005°
γ	90°
Cell volume	1828.2 ± 0.3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0972
Residual factor for significantly intense reflections	0.0572
Weighted residual factors for significantly intense reflections	0.1166
Weighted residual factors for all reflections included in the refinement	0.135
Goodness-of-fit parameter for all reflections included in the refinement	1.077
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
180089 (current)	2016-03-26	cif/7/05/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/05/35.	7053559.cif
93718	2014-01-13	cif/ Adding structures of 7053557, 7053558, 7053559 via cif-deposit CGI script.	7053559.cif