Crystallography Open Database

Information card for entry 4087952

Preview

Coordinates	4087952.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C19 H31 Cl2 Fe N3 O Pt S
Calculated formula	C19 H31 Cl2 Fe N3 O Pt S
Title of publication	Catalytically Generated Ferrocene-Containing Guanidines as Efficient Precursors for New Redox-Active Heterometallic Platinum(II) Complexes with Anticancer Activity
Authors of publication	Nieto, Daniel; Bruña, Sonia; González-Vadillo, Ana M; Perles, Josefina; Carrillo-Hermosilla, Fernando; Antiñolo, Antonio; Padrón, José M.; Plata, Gabriela B.; Cuadrado, Isabel
Journal of publication	Organometallics
Year of publication	2015
Journal volume	34
Journal issue	22
Pages of publication	5407
a	9.3472 ± 0.0004 Å
b	19.7677 ± 0.0006 Å
c	25.5026 ± 0.001 Å
α	90°
β	90°
γ	90°
Cell volume	4712.2 ± 0.3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	8
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0619
Residual factor for significantly intense reflections	0.039
Weighted residual factors for significantly intense reflections	0.1173
Weighted residual factors for all reflections included in the refinement	0.1429
Goodness-of-fit parameter for all reflections included in the refinement	1.033
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
237155 (current)	2019-11-24	cif/ Adding structures of 4087951, 4087952, 4087953, 4087954, 4087955 via cif-deposit CGI script.	4087952.cif