Crystallography Open Database

Information card for entry 7024280

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Structure parameters

Formula	C35 H45 F3 Ge N2 O S
Calculated formula	C35 H45 F3 Ge N2 O S
SMILES	[Ge]1(OC(C(F)(F)F)c2sccc2)[N](c2c(cccc2C(C)C)C(C)C)=C(C)C=C(N1c1c(cccc1C(C)C)C(C)C)C
Title of publication	Reactivity of germanium(II) hydride with nitrous oxide, trimethylsilyl azide, ketones, and alkynes and the reaction of a methyl analogue with trimethylsilyl diazomethane.
Authors of publication	Jana, Anukul; Roesky, Herbert W.; Schulzke, Carola
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2010
Journal volume	39
Journal issue	1
Pages of publication	132 - 138
a	12.142 ± 0.002 Å
b	8.7405 ± 0.0017 Å
c	32.073 ± 0.006 Å
α	90°
β	98.61 ± 0.03°
γ	90°
Cell volume	3365.5 ± 1.1 Å³
Cell temperature	133 ± 2 K
Ambient diffraction temperature	133 ± 2 K
Number of distinct elements	7
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	0.0578
Residual factor for significantly intense reflections	0.0537
Weighted residual factors for significantly intense reflections	0.1363
Weighted residual factors for all reflections included in the refinement	0.1385
Goodness-of-fit parameter for all reflections included in the refinement	1.199
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
301848 (current)	2025-08-21	Add cross-references to PubChem compounds in COD range 7/02/ Each referenced PubChem compound corresponds to the full crystal structure.	7024280.cif
179947	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/42.	7024280.cif
92343	2014-01-12	cif/ Adding structures of 7024276, 7024277, 7024278, 7024279, 7024280 via cif-deposit CGI script.	7024280.cif