Crystallography Open Database

Information card for entry 7027786

Preview

Coordinates	7027786.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H28 Cl Mg O P
Calculated formula	C7 H14 Cl0.5 Mg0.5 O0.5 P0.5
Title of publication	A convenient synthetic route to substituted phosphavinyl Grignard reagents: synthesis and characterisation of [{RPC(But)MgX(OEt2)}2] (R = cyclohexyl, cyclopentyl, ethyl or mesityl; X = Cl or Br) †
Authors of publication	Hibbs, David E.; Jones, Cameron; Richards, Anne F.
Journal of publication	Journal of the Chemical Society, Dalton Transactions
Year of publication	1999
Journal issue	20
Pages of publication	3531
a	8.162 ± 0.009 Å
b	9.682 ± 0.007 Å
c	12.341 ± 0.01 Å
α	70.69 ± 0.02°
β	75.44 ± 0.018°
γ	78.995 ± 0.016°
Cell volume	884.6 ± 1.4 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0388
Residual factor for significantly intense reflections	0.0346
Weighted residual factors for significantly intense reflections	0.0951
Weighted residual factors for all reflections included in the refinement	0.0972
Goodness-of-fit parameter for all reflections included in the refinement	1.074
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
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7027786.cif
95785	2014-01-28	cif/ Adding structures of 7027785, 7027786 via cif-deposit CGI script.	7027786.cif