Crystallography Open Database

Information card for entry 7224297

Preview

Coordinates	7224297.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H34 B N3
Calculated formula	C22 H34 B N3
SMILES	N(C(C)C)(C(C)C)B(Nc1c(cccc1C)C)Nc1c(cccc1C)C
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	8.6562 ± 0.0005 Å
b	10.284 ± 0.0004 Å
c	12.9948 ± 0.0008 Å
α	73.067 ± 0.004°
β	86.43 ± 0.005°
γ	76.579 ± 0.003°
Cell volume	1076.41 ± 0.1 Å³
Cell temperature	150 ± 1 K
Ambient diffraction temperature	150 ± 1 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0648
Residual factor for significantly intense reflections	0.05
Weighted residual factors for significantly intense reflections	0.1201
Weighted residual factors for all reflections included in the refinement	0.1354
Goodness-of-fit parameter for all reflections included in the refinement	1.072
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.	7224297.cif