Crystallography Open Database

Information card for entry 7036035

Preview

Coordinates	7036035.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H50 Cl2 N2 P Sb
Calculated formula	C48 H50 Cl2 N2 P Sb
SMILES	[Sb]1(Cl)(Cl)[N](c2c(cccc2c2c(cc(cc2C)C)C)c2c(cc(cc2C)C)C)=PN1c1c(cccc1c1c(cc(cc1C)C)C)c1c(cc(cc1C)C)C
Title of publication	Reduction of dichloro(diaza-phospha)stibanes - isolation of a donor-stabilized distibenium dication.
Authors of publication	Hinz, Alexander; Rothe, Julia; Schulz, Axel; Villinger, Alexander
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2016
Journal volume	45
Journal issue	14
Pages of publication	6044 - 6052
a	12.0987 ± 0.0009 Å
b	22.5405 ± 0.0018 Å
c	16.4923 ± 0.0014 Å
α	90°
β	106.879 ± 0.003°
γ	90°
Cell volume	4303.9 ± 0.6 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.1108
Residual factor for significantly intense reflections	0.0513
Weighted residual factors for significantly intense reflections	0.1075
Weighted residual factors for all reflections included in the refinement	0.1354
Goodness-of-fit parameter for all reflections included in the refinement	1.016
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
181722 (current)	2016-04-05	cif/ Updating files of 7036034, 7036035, 7036036, 7036037, 7036038, 7036039 Original log message: Adding full bibliography for 7036034--7036039.cif.	7036035.cif
152717	2015-08-04	cif/ Adding structures of 7036034, 7036035, 7036036, 7036037, 7036038, 7036039 via cif-deposit CGI script.	7036035.cif