Crystallography Open Database

Information card for entry 4087849

Preview

Coordinates	4087849.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C15 H23 F Ge N2 S
Calculated formula	C15 H23 F Ge N2 S
SMILES	[Ge]1(=S)(F)N(C2=CC=CC=CC2=[N]1C(C)(C)C)C(C)(C)C
Title of publication	Reactivity of LGe‒NR2 and LGe(E)‒NR2 over LGe‒Cl and LGe(E)‒Cl toward Me3SiX (L = Aminotroponiminate; NR2 = N(SiMe3)2/NC4H4; E = S/Se; X = Br/CN)
Authors of publication	Siwatch, Rahul Kumar; Karwasara, Surendar; Sharma, Mahendra Kumar; Mondal, Santigopal; Mukherjee, Goutam; Rajaraman, Gopalan; Nagendran, Selvarajan
Journal of publication	Organometallics
Year of publication	2016
Journal volume	35
Journal issue	4
Pages of publication	429
a	16.208 ± 0.004 Å
b	13.886 ± 0.004 Å
c	16.841 ± 0.004 Å
α	90°
β	116.812 ± 0.004°
γ	90°
Cell volume	3382.8 ± 1.5 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0526
Residual factor for significantly intense reflections	0.0401
Weighted residual factors for significantly intense reflections	0.1053
Weighted residual factors for all reflections included in the refinement	0.1147
Goodness-of-fit parameter for all reflections included in the refinement	1.051
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
237045 (current)	2019-11-24	cif/ Adding structures of 4087843, 4087844, 4087845, 4087846, 4087847, 4087848, 4087849 via cif-deposit CGI script.	4087849.cif