Crystallography Open Database

Information card for entry 7027627

Preview

Coordinates	7027627.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	pentakis(dimethylamido)tantalum(V)
Formula	C10 H30 N5 Ta
Calculated formula	C10 H30 N5 Ta
Title of publication	Transition metal dicarbollide complexes: synthesis, molecular, crystal and electronic structures of [M(C2B9H11)(NMe2)3] (M = Nb or Ta) and their insertion reactions with CO2 and CS2 †
Authors of publication	Batsanov, Andrei S.; Churakov, Andrei V.; Howard, Judith A. K.; Hughes, Andrew K.; Johnson, Andrew L.; Kingsley, Andrew J.; Neretin, Ivan S.; Wade, Ken
Journal of publication	Journal of the Chemical Society, Dalton Transactions
Year of publication	1999
Journal issue	21
Pages of publication	3867
a	13.845 ± 0.003 Å
b	7.9 ± 0.002 Å
c	14.544 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	1590.8 ± 0.6 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	4
Space group number	63
Hermann-Mauguin space group symbol	C m c m
Hall space group symbol	-C 2c 2
Residual factor for all reflections	0.0269
Residual factor for significantly intense reflections	0.0267
Weighted residual factors for significantly intense reflections	0.0656
Weighted residual factors for all reflections included in the refinement	0.0661
Goodness-of-fit parameter for all reflections included in the refinement	1.217
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
179982 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/76.	7027627.cif
132627	2015-03-03	cif/ (antanas@koala.ibt.lt) Removing unrecognised tags from CIFs in range 4/ and range 7/.	7027627.cif
95569	2014-01-28	cif/ Adding structures of 7027627, 7027628, 7027629, 7027630, 7027631 via cif-deposit CGI script.	7027627.cif