Crystallography Open Database

Information card for entry 7245628

Preview

Coordinates	7245628.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	3,3'-(dimethylsilanediyl)bis(4-bromo-N,N-dimethylaniline)
Formula	C18 H24 Br2 N2 Si
Calculated formula	C18 H24 Br2 N2 Si
Title of publication	Bioorthogonal site-selective conjugation of fluorescent dyes to antibodies: method and potential applications
Authors of publication	Grossenbacher, Philipp; Essers, Maria C.; Moser, Joël; Singer, Simon A.; Häusler, Stephanie; Stieger, Bruno; Rougier, Jean-Sébastien; Lochner, Martin
Journal of publication	RSC Advances
Year of publication	2022
Journal volume	12
Journal issue	44
Pages of publication	28306 - 28317
a	8.6606 ± 0.0002 Å
b	18.8553 ± 0.0002 Å
c	12.7788 ± 0.0003 Å
α	90°
β	107.662 ± 0.002°
γ	90°
Cell volume	1988.39 ± 0.07 Å³
Cell temperature	173 ± 0.1 K
Ambient diffraction temperature	173 ± 0.1 K
Number of distinct elements	5
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	0.0478
Residual factor for significantly intense reflections	0.0335
Weighted residual factors for significantly intense reflections	0.0584
Weighted residual factors for all reflections included in the refinement	0.0627
Goodness-of-fit parameter for all reflections included in the refinement	1.045
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
278375 (current)	2022-10-06	cif/ Adding structures of 7245626, 7245627, 7245628, 7245629 via cif-deposit CGI script.	7245628.cif