Crystallography Open Database

Information card for entry 7710530

Preview

Coordinates	7710530.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C54 H68 Cl6 Ga2 P4
Calculated formula	C54 H68 Cl6 Ga2 P4
SMILES	[Ga](P([P+](C)(C)C)c1c(c2c(cc(cc2C)C)C)cccc1c1c(cc(cc1C)C)C)(P([P+](C)(C)C)c1c(c2c(cc(cc2C)C)C)cccc1c1c(cc(cc1C)C)C)(Cl)Cl.[Ga]([Cl-])(Cl)(Cl)Cl
Title of publication	Modulating the reactivity of phosphanylidenephosphoranes towards water with Lewis acids
Authors of publication	Dankert, Fabian; Fischer, Malte; Hering-Junghans, Christian
Journal of publication	Dalton Transactions
Year of publication	2022
a	12.9253 ± 0.0012 Å
b	21.2504 ± 0.0019 Å
c	24.984 ± 0.002 Å
α	109.535 ± 0.007°
β	97.03 ± 0.007°
γ	90.092 ± 0.007°
Cell volume	6412 ± 1 Å³
Cell temperature	150 K
Ambient diffraction temperature	150 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1467
Residual factor for significantly intense reflections	0.0691
Weighted residual factors for significantly intense reflections	0.1642
Weighted residual factors for all reflections included in the refinement	0.1839
Goodness-of-fit parameter for all reflections included in the refinement	0.873
Diffraction radiation probe	x-ray
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
276205 (current)	2022-06-24	cif/ Adding structures of 7710529, 7710530, 7710531, 7710532, 7710533, 7710534, 7710535, 7710536, 7710537, 7710538, 7710539, 7710540, 7710541, 7710542, 7710543, 7710544 via cif-deposit CGI script.	7710530.cif