Crystallography Open Database

Information card for entry 7224299

Preview

Coordinates	7224299.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C54 H82 B Ge N5
Calculated formula	C48 H68 B Ge N5
SMILES	[Ge]12(N(c3c(C(C)C)cccc3C(C)C)C=CN1c1c(C(C)C)cccc1C(C)C)N(c1c(C)cccc1C)B(N2c1c(cccc1C)C)N(C(C)C)C(C)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	12.41 ± 0.0012 Å
b	15.971 ± 0.0005 Å
c	26.276 ± 0.003 Å
α	101.799 ± 0.006°
β	95.207 ± 0.008°
γ	98.138 ± 0.005°
Cell volume	5007.9 ± 0.8 Å³
Cell temperature	150 ± 1 K
Ambient diffraction temperature	150 ± 1 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	0.0658
Residual factor for significantly intense reflections	0.0449
Weighted residual factors for significantly intense reflections	0.102
Weighted residual factors for all reflections included in the refinement	0.1155
Goodness-of-fit parameter for all reflections included in the refinement	1.087
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.	7224299.cif