Crystallography Open Database

Information card for entry 1570907

Preview

Coordinates	1570907.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C41 H43 Cl N O7 P Pd
Calculated formula	C41 H43 Cl N O7 P Pd
Title of publication	Rational Design of Palladium(II) Indenyl and Allyl Complexes Bearing Phosphine and Isocyanide Ancillary Ligands with Promising Antitumor Activity.
Authors of publication	Bortolamiol, Enrica; Botter, Eleonora; Cavarzerani, Enrico; Mauceri, Matteo; Demitri, Nicola; Rizzolio, Flavio; Visentin, Fabiano; Scattolin, Thomas
Journal of publication	Molecules (Basel, Switzerland)
Year of publication	2024
Journal volume	29
Journal issue	2
Pages of publication	345
a	12.186 ± 0.002 Å
b	12.335 ± 0.002 Å
c	13.003 ± 0.003 Å
α	83.54 ± 0.03°
β	81.05 ± 0.03°
γ	88.43 ± 0.03°
Cell volume	1918.4 ± 0.7 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0443
Residual factor for significantly intense reflections	0.0405
Weighted residual factors for significantly intense reflections	0.1207
Weighted residual factors for all reflections included in the refinement	0.1263
Goodness-of-fit parameter for all reflections included in the refinement	1.042
Diffraction radiation wavelength	0.62 Å
Diffraction radiation type	Synchrotron
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
289666 (current)	2024-02-05	cif/ Adding structures of 1570907 via cif-deposit CGI script.	1570907.cif