Crystallography Open Database

Information card for entry 7115005

Preview

Coordinates	7115005.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H45 Ag Cl9 N5 Pd
Calculated formula	C40 H45 Ag Cl9 N5 Pd
Title of publication	Chiral 2,6-lutidinyl-biscarbene complexes of palladium
Authors of publication	Tulloch, Arran A. D.; Danopoulos, Andreas A.; Tizzard, Graham J.; Coles, Simon J.; Hursthouse, Michael B.; Hay-Motherwell, Robyn S.; Motherwell, William B.
Journal of publication	Chemical Communications
Year of publication	2001
Journal issue	14
Pages of publication	1270
a	11.559 ± 0.002 Å
b	42.043 ± 0.008 Å
c	10.631 ± 0.002 Å
α	90°
β	112.51 ± 0.03°
γ	90°
Cell volume	4772.8 ± 1.8 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 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	0.0897
Residual factor for significantly intense reflections	0.0514
Weighted residual factors for significantly intense reflections	0.1185
Weighted residual factors for all reflections included in the refinement	0.134
Goodness-of-fit parameter for all reflections included in the refinement	1.026
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
180264 (current)	2016-03-26	cif/7/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/11/50.	7115005.cif
118474	2014-06-30	cif/ Adding structures of 7115005, 7115006 via cif-deposit CGI script.	7115005.cif