Crystallography Open Database

Information card for entry 4076870

Preview

Coordinates	4076870.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H36 N2 V
Calculated formula	C24 H36 N2 V
Title of publication	Synthesis and Structure of Amino-Functionalized Cyclopentadienyl Vanadium Complexes and Evaluation of Their Butadiene Polymerization Behavior
Authors of publication	Bradley, Sam; Camm, Kenneth D.; Furtado, Stephen J.; Gott, Andrew L.; McGowan, Patrick C.; Podesta, Thomas J.; Thornton-Pett, Mark
Journal of publication	Organometallics
Year of publication	2002
Journal volume	21
Journal issue	16
Pages of publication	3443
a	6.0103 ± 0.0001 Å
b	11.5924 ± 0.0002 Å
c	15.6388 ± 0.0003 Å
α	90°
β	97.878 ± 0.0011°
γ	90°
Cell volume	1079.33 ± 0.03 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	4
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	0.0635
Residual factor for significantly intense reflections	0.0614
Weighted residual factors for significantly intense reflections	0.1578
Weighted residual factors for all reflections included in the refinement	0.1591
Goodness-of-fit parameter for all reflections included in the refinement	1.148
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
178657 (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 4/07/68.	4076870.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4076870.cif
54097	2012-04-20	cif/ Adding structures of 4076869, 4076870, 4076871, 4076872, 4076873, 4076874, 4076875, 4076876 via cif-deposit CGI script.	4076870.cif