Crystallography Open Database

Information card for entry 7159323

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Coordinates	7159323.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C73 H78 N8 Zn2
Calculated formula	C73 H70 N8 Zn2
Title of publication	NHC-Zn alkyl catalyzed cross-dehydrocoupling of amines and silanes.
Authors of publication	Harinath, Adimulam; Karmakar, Himadri; Kisan, Devadkar Ajitaro; Nayek, Hari Pada; Panda, Tarun K.
Journal of publication	Organic & biomolecular chemistry
Year of publication	2023
Journal volume	21
Journal issue	20
Pages of publication	4237 - 4244
a	11.3098 ± 0.0007 Å
b	12.4371 ± 0.0015 Å
c	12.7916 ± 0.0013 Å
α	113.736 ± 0.011°
β	104.197 ± 0.007°
γ	95.841 ± 0.007°
Cell volume	1555.5 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 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	0.0918
Residual factor for significantly intense reflections	0.0687
Weighted residual factors for significantly intense reflections	0.1934
Weighted residual factors for all reflections included in the refinement	0.2183
Goodness-of-fit parameter for all reflections included in the refinement	0.926
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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