Crystallography Open Database

Information card for entry 7703190

Preview

Coordinates	7703190.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C70 H64 B2 Cl22 F8 Fe2 N6 P2 Pd2
Calculated formula	C64 H58 B2 Cl4 F8 Fe2 N6 P2 Pd2
Title of publication	Synthesis and characterisation of Pd(ii) and Au(i) complexes with mesoionic carbene ligands bearing phosphinoferrocene substituents and isomeric carbene moieites.
Authors of publication	Škoch, Karel; Vosáhlo, Petr; Císařová, Ivana; Štěpnička, Petr
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	4
Pages of publication	1011 - 1021
a	12.7439 ± 0.0006 Å
b	13.7121 ± 0.0007 Å
c	14.1452 ± 0.0007 Å
α	74.101 ± 0.002°
β	72.724 ± 0.002°
γ	82.338 ± 0.002°
Cell volume	2266.4 ± 0.2 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	9
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0303
Residual factor for significantly intense reflections	0.0256
Weighted residual factors for significantly intense reflections	0.0623
Weighted residual factors for all reflections included in the refinement	0.0644
Goodness-of-fit parameter for all reflections included in the refinement	1.035
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
247708 (current)	2020-02-04	cif/ Updating files of 7703178, 7703179, 7703180, 7703181, 7703182, 7703183, 7703184, 7703185, 7703186, 7703187, 7703188, 7703189, 7703190, 7703191, 7703192, 7703193 Original log message: Adding full bibliography for 7703178--7703193.cif.	7703190.cif
246524	2020-01-04	cif/ Adding structures of 7703178, 7703179, 7703180, 7703181, 7703182, 7703183, 7703184, 7703185, 7703186, 7703187, 7703188, 7703189, 7703190, 7703191, 7703192, 7703193 via cif-deposit CGI script.	7703190.cif