Crystallography Open Database

Information card for entry 4114235

Preview

Coordinates	4114235.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	JDS-IV-16
Chemical name	JDS-IV-16
Formula	C19 H25 B Cl2 N7 Os
Calculated formula	C19 H25 B Cl2 N7 Os
Title of publication	Slow Hydrogen Atom Self-Exchange between Os(IV) Anilide and Os(III) Aniline Complexes: Relationships with Electron and Proton Transfer Self-Exchange
Authors of publication	Jake D. Soper; James M. Mayer
Journal of publication	Journal of the American Chemical Society
Year of publication	2003
Journal volume	125
Pages of publication	12217 - 12229
a	13.851 ± 0.0017 Å
b	8.624 ± 0.0011 Å
c	19.889 ± 0.003 Å
α	90°
β	107.515 ± 0.008°
γ	90°
Cell volume	2265.6 ± 0.5 Å³
Cell temperature	130 ± 2 K
Ambient diffraction temperature	130 ± 2 K
Number of distinct elements	6
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	0.1304
Residual factor for significantly intense reflections	0.0535
Weighted residual factors for significantly intense reflections	0.0891
Weighted residual factors for all reflections included in the refinement	0.1075
Goodness-of-fit parameter for all reflections included in the refinement	0.934
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
178913 (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 4/11/42.	4114235.cif
171491	2015-12-13	cif/ (antanas@echidna.ibt.lt) Removing surrounding qoutes ("'") from the _chemical_name_systematic tag values in multiple entries in range 4.	4114235.cif
120077	2014-07-12	Adding DOIs to range 4/11 structures.	4114235.cif
67520	2012-09-27	cif/ Adding structures of 4114235 via cif-deposit CGI script.	4114235.cif