Crystallography Open Database

Information card for entry 4072343

Preview

Coordinates	4072343.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27 H39 Cl Co N3 O P2
Calculated formula	C216 H324 Cl8 Co8 N24 O8 P16
Title of publication	N-Assisted Carbon−Hydrogen Bond Activation by Cobalt(I) Complexes
Authors of publication	Wang, Aichen; Sun, Hongjian; Li, Xiaoyan
Journal of publication	Organometallics
Year of publication	2008
Journal volume	27
Journal issue	21
Pages of publication	5434
a	17.122 ± 0.003 Å
b	10.182 ± 0.002 Å
c	32.959 ± 0.007 Å
α	90°
β	90°
γ	90°
Cell volume	5745.9 ± 1.9 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	33
Hermann-Mauguin space group symbol	P n a 21
Hall space group symbol	P 2c -2n
Residual factor for all reflections	0.114
Residual factor for significantly intense reflections	0.0577
Weighted residual factors for significantly intense reflections	0.1333
Weighted residual factors for all reflections included in the refinement	0.1546
Goodness-of-fit parameter for all reflections included in the refinement	0.853
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
178612 (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 4/07/23.	4072343.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4072343.cif
47256	2012-03-23	cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories.	4072343.cif
44358	2012-03-15	../uploads/cif-deposit/cod/cif Adding structures of 4072343 via cif-deposit CGI script.	4072343.cif