Crystallography Open Database

Information card for entry 4119331

4119330 << 4119331 >> 4119332

Preview

Coordinates	4119331.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H34 Ag B Mn2 N2 O4
Calculated formula	C38 H34 Ag B Mn2 N2 O4
Title of publication	Ditopic Ambiphilicity of an Anionic Dimetalloborylene Complex
Authors of publication	Holger Braunschweig; Alexander Damme; Rian D. Dewhurst; Thomas Kramer; Sebastian Östreicher; Krzysztof Radacki; Alfredo Vargas
Journal of publication	Journal of the American Chemical Society
Year of publication	2013
Journal volume	135
Pages of publication	2313 - 2320
a	8.9066 ± 0.0007 Å
b	17.705 ± 0.0013 Å
c	23.0059 ± 0.0018 Å
α	75.632 ± 0.003°
β	89.376 ± 0.003°
γ	79.664 ± 0.003°
Cell volume	3455.2 ± 0.5 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0392
Residual factor for significantly intense reflections	0.0313
Weighted residual factors for significantly intense reflections	0.0755
Weighted residual factors for all reflections included in the refinement	0.0819
Goodness-of-fit parameter for all reflections included in the refinement	1.019
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
178964 (current)	2016-03-22	cif/4/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/11/93.	4119331.cif
103470	2014-03-04	cif/ Adding structures of 4119331 via cif-deposit CGI script.	4119331.cif