Formulation, Molecular Charge Topography, and Nosocomial Anti-Infectious Potential of Ruthenium Carbonyl Complex of N-o-Hydroxyacetophenone-Ethylenediamine-N′-o-Vanillin: Table 2

Table 2: Selected geometrical optimization parameters of the complex.


Atom connectivity	Bond length (Ǻ)	Atom connectivity	Bond angle (°)

O(16)—Ru(24)	2.12	N(22)—Ru(24)—C(25)	167.04
P(27)—Ru(24)	2.40	N(21)—Ru(24)—P(27)	165.68
O(6)—Ru(24)	2.14	O(16)—Ru(24)—O(6)	177.44
C(25)—Ru(24)	1.87	O(16)—Ru(24)—C(25)	91.50
N(21)—Ru(24)	2.14	P(27)—Ru(24)—C(25)	90.75
N(22)—Ru(24)	2.20	O(6)—Ru(24)—P(27)	93.58
		N(22)—Ru(24)—O(6)	77.86
		N(21)—Ru(24)—N(22)	77.36
		N(21)—Ru(24)—O(16)	81.88


Atom connectivity	Dihedral angle (°)

N(22)—Ru(24)—C(25)—O(26)	23.57
N(22)—Ru(24)—P(27)—H(46)	−100.55
N(22)—Ru(24)—O(6)—C(5)	135.31
N(21)—Ru(24)—N(22)—C(7)	−142.47
N(21)—Ru(24)—O(16)—C(13)	51.91
C(13)—O(16)—Ru(24)—C(25)	−45.74
O(26)—C(25)—Ru(24)—O(16)	172.60
Ru(24)—N(21)—C(20)—C(19)	−47.62