Crystallography Open Database

Information card for entry 7044996

Preview

Coordinates	7044996.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	[K(crypt-222)][(Tbb)GeBr2]
Chemical name	Tbb-germylemoid
Formula	C45 H88 Br2 Ge K N2 O6 Si4
Calculated formula	C45 H88 Br2 Ge K N2 O6 Si4
Title of publication	1,2-Dihalodigermenes bearing bulky Eind groups: synthesis, characterization, and conversion to halogermylenoids.
Authors of publication	Hayakawa, Naoki; Sugahara, Tomohiro; Numata, Yasuyuki; Kawaai, Hotaka; Yamatani, Kenta; Nishimura, Shogo; Goda, Shun; Suzuki, Yuko; Tanikawa, Tomoharu; Nakai, Hidetaka; Hashizume, Daisuke; Sasamori, Takahiro; Tokitoh, Norihiro; Matsuo, Tsukasa
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2018
Journal volume	47
Journal issue	3
Pages of publication	814 - 822
a	11.8021 ± 0.0002 Å
b	12.4235 ± 0.0003 Å
c	20.4661 ± 0.0004 Å
α	79.322 ± 0.001°
β	78.119 ± 0.001°
γ	85.935 ± 0.001°
Cell volume	2884 ± 0.1 Å³
Cell temperature	103 K
Ambient diffraction temperature	103 K
Number of distinct elements	8
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0943
Residual factor for significantly intense reflections	0.0872
Weighted residual factors for significantly intense reflections	0.2161
Weighted residual factors for all reflections included in the refinement	0.22
Goodness-of-fit parameter for all reflections included in the refinement	1.2
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
230073 (current)	2019-11-17	cif/ Updating files of 7044992, 7044993, 7044994, 7044995, 7044996, 7044997 Original log message: Adding full bibliography for 7044992--7044997.cif.	7044996.cif
204065	2017-12-08	cif/ Adding structures of 7044992, 7044993, 7044994, 7044995, 7044996, 7044997 via cif-deposit CGI script.	7044996.cif