Crystallography Open Database

Information card for entry 7235553

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Structure parameters

Formula	C19 H17 N3 O S
Calculated formula	C19 H17 N3 O S
Title of publication	DNA/protein binding and cytotoxicity studies of copper(ii) complexes containing N,N′,N′′-trisubstituted guanidine ligands
Authors of publication	Jeyalakshmi, Kumaramangalam; Selvakumaran, Nagamani; Bhuvanesh, Nattamai S. P.; Sreekanth, Anantharaman; Karvembu, Ramasamy
Journal of publication	RSC Advances
Year of publication	2014
Journal volume	4
Journal issue	33
Pages of publication	17179
a	17.941 ± 0.004 Å
b	9.5618 ± 0.0019 Å
c	20.779 ± 0.004 Å
α	90°
β	107.292 ± 0.002°
γ	90°
Cell volume	3403.5 ± 1.2 Å³
Cell temperature	110 ± 2 K
Ambient diffraction temperature	110 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0402
Residual factor for significantly intense reflections	0.0357
Weighted residual factors for significantly intense reflections	0.0885
Weighted residual factors for all reflections included in the refinement	0.0921
Goodness-of-fit parameter for all reflections included in the refinement	1.027
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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