Crystallography Open Database

Information card for entry 7224301

Preview

Coordinates	7224301.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C34 H42 B Ge N3 S2
Calculated formula	C34 H42 B Ge N3 S2
SMILES	[Ge]1(Sc2ccccc2)(Sc2ccccc2)N(B(N1c1c(C)cccc1C)N(C(C)C)C(C)C)c1c(C)cccc1C
Title of publication	Synthesis and reactivity of a germylene stabilized by a boraguanidinate ligand
Authors of publication	Böserle, Jiří; Alonso, Mercedes; Jambor, Roman; Růžička, Aleš; Dostál, Libor
Journal of publication	RSC Adv.
Year of publication	2016
Journal volume	6
Journal issue	23
Pages of publication	19377
a	20.0901 ± 0.0014 Å
b	8.496 ± 0.0004 Å
c	19.6849 ± 0.0016 Å
α	90°
β	91.921 ± 0.006°
γ	90°
Cell volume	3358 ± 0.4 Å³
Cell temperature	150 ± 1 K
Ambient diffraction temperature	150 ± 1 K
Number of distinct elements	6
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	0.0592
Residual factor for significantly intense reflections	0.0366
Weighted residual factors for significantly intense reflections	0.0712
Weighted residual factors for all reflections included in the refinement	0.0832
Goodness-of-fit parameter for all reflections included in the refinement	1.104
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
176720 (current)	2016-02-18	cif/ Adding structures of 7224296, 7224297, 7224298, 7224299, 7224300, 7224301, 7224302, 7224303, 7224304, 7224305, 7224306, 7224307, 7224308 via cif-deposit CGI script.	7224301.cif