Crystallography Open Database

Information card for entry 7226575

Preview

Coordinates	7226575.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C34 H35 Cl N2 O2 Ru
Calculated formula	C34 H35 Cl N2 O2 Ru
SMILES	[Ru]123456(Oc7ccccc7C=[N]1c1ccc(cc1)C(=O)/C=C/c1ccc(N(C)C)cc1)(Cl)[c]1([cH]2[cH]3[c]4([cH]5[cH]61)C(C)C)C
Title of publication	Arene Ruthenium (II) Complexes with Chalcone, Aminoantipyrine and Aminopyrimidine Based Ligands: Synthesis, Structure and Preliminary Evaluation of Anti-leukemia Activity
Authors of publication	Pitchaimani, J.; Raja, MR Charan; Srinivasan, Sujatha; Kar Mahapatra, Santanu; Moon, Dohyun; Anthony, Savarimuthu Philip; Madhu, Vedichi
Journal of publication	RSC Adv.
Year of publication	2016
a	9.096 ± 0.0018 Å
b	11.993 ± 0.002 Å
c	14.283 ± 0.003 Å
α	74.2 ± 0.03°
β	75.55 ± 0.03°
γ	89.72 ± 0.03°
Cell volume	1448.5 ± 0.6 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0314
Residual factor for significantly intense reflections	0.0272
Weighted residual factors for significantly intense reflections	0.075
Weighted residual factors for all reflections included in the refinement	0.0762
Goodness-of-fit parameter for all reflections included in the refinement	1.07
Diffraction radiation wavelength	0.61 Å
Diffraction radiation type	synchrotron
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
186624 (current)	2016-09-17	cif/ Adding structures of 7226575, 7226576, 7226577 via cif-deposit CGI script.	7226575.cif