Crystallography Open Database

Information card for entry 1555425

Preview

Coordinates	1555425.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C39 H46 N2 Si2
Calculated formula	C39 H46 N2 Si2
SMILES	[Si](N(/C(=C(/N([Si](C)(C)C)c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1)(C)(C)C.c1(ccccc1)C
Title of publication	Interaction of Azobenzene and Benzalaniline with Strong Amido Bases.
Authors of publication	Kornev, Alexander N.; Sushev, Vyacheslav V.; Zolotareva, Natalia V.; Baranov, Evgenii V.; Fukin, Georgy K.; Abakumov, Gleb A.
Journal of publication	Organic letters
Year of publication	2015
Journal volume	17
Journal issue	24
Pages of publication	6154 - 6157
a	13.9869 ± 0.0011 Å
b	12.5966 ± 0.0011 Å
c	19.4789 ± 0.0018 Å
α	90°
β	90°
γ	90°
Cell volume	3431.9 ± 0.5 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	4
Space group number	29
Hermann-Mauguin space group symbol	P c a 21
Hall space group symbol	P 2c -2ac
Residual factor for all reflections	0.034
Residual factor for significantly intense reflections	0.0299
Weighted residual factors for significantly intense reflections	0.0721
Weighted residual factors for all reflections included in the refinement	0.074
Goodness-of-fit parameter for all reflections included in the refinement	1.035
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
238650 (current)	2019-11-24	cif/ Adding structures of 1555422, 1555423, 1555424, 1555425 via cif-deposit CGI script.	1555425.cif