Crystallography Open Database

Information card for entry 4340663

Preview

Coordinates	4340663.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H55 Cl2 O4 P2 Pd
Calculated formula	C38 H55 Cl2 O4 P2 Pd
Title of publication	Flexible Coordination of Diphosphine Ligands Leading to cis and trans Pd(0), Pd(II), and Rh(I) Complexes.
Authors of publication	Comanescu, Cezar C.; Iluc, Vlad M.
Journal of publication	Inorganic chemistry
Year of publication	2014
Journal volume	53
Journal issue	16
Pages of publication	8517 - 8528
a	10.4111 ± 0.0015 Å
b	12.9808 ± 0.0018 Å
c	14.58 ± 0.002 Å
α	90°
β	102.458 ± 0.002°
γ	90°
Cell volume	1924 ± 0.5 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	6
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/n 1
Hall space group symbol	-P 2yac
Residual factor for all reflections	0.0495
Residual factor for significantly intense reflections	0.0443
Weighted residual factors for significantly intense reflections	0.0977
Weighted residual factors for all reflections included in the refinement	0.1
Goodness-of-fit parameter for all reflections included in the refinement	1.185
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
179509 (current)	2016-03-23	cif/4/34/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/34/06.	4340663.cif
122891	2014-09-06	cif/ Updating files of 4340659, 4340660, 4340661, 4340662, 4340663, 4340664, 4340665, 4340666, 4340667, 4340668, 4340669 Original log message: Adding full bibliography for 4340659--4340669.cif.	4340663.cif
121997	2014-08-18	cif/ Adding structures of 4340659, 4340660, 4340661, 4340662, 4340663, 4340664, 4340665, 4340666, 4340667, 4340668, 4340669 via cif-deposit CGI script.	4340663.cif