Crystallography Open Database

Information card for entry 4072034

4072033 << 4072034 >> 4072035

Preview

Coordinates	4072034.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H23 Cl N4 O4
Calculated formula	C24 H23 Cl N4 O4
Title of publication	Stereoselective Synthesis of Rhodium(I) 4-(Dialkylamino)triazol-5-ylidene Complexes
Authors of publication	Ros, Abel; Alcarazo, Manuel; Iglesias-Sigüenza, Javier; Díez, Elena; Álvarez, Eleuterio; Fernández, Rosario; Lassaletta, José M.
Journal of publication	Organometallics
Year of publication	2008
Journal volume	27
Journal issue	18
Pages of publication	4555
a	13.6299 ± 0.0018 Å
b	18.071 ± 0.003 Å
c	18.99 ± 0.003 Å
α	90°
β	101.484 ± 0.004°
γ	90°
Cell volume	4583.7 ± 1.2 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0922
Residual factor for significantly intense reflections	0.0682
Weighted residual factors for significantly intense reflections	0.1758
Weighted residual factors for all reflections included in the refinement	0.1938
Goodness-of-fit parameter for all reflections included in the refinement	1.046
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
178609 (current)	2016-03-21	cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/20.	4072034.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4072034.cif
47256	2012-03-23	cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories.	4072034.cif
44187	2012-03-15	../uploads/cif-deposit/cod/cif Adding structures of 4072034 via cif-deposit CGI script.	4072034.cif