Quantum Chemical Study of Mixed-Ligand Monometallic Ruthenium(II) Complex of Composition [(bpy)₂Ru(H₃Imbzim)](ClO₄)₂·2H₂O

Table 1

(a) Comparison of selected bond lengths and (b) comparison of selected bond angles.

(a)

Serial number	Name of bond lengths	Bond lengths
		Computed	Experimental
1	Ru-N6	2.060	2.033
2	Ru-N4	2.072	2.039
3	Ru-N3	2.067	2.039
4	Ru-N5	2.074	2.074
5	Ru-N8	2.112	2.077
6	Ru-N1	2.093	2.093

(b)

Serial number	Name of bond angles	Bond angles (in degree)
		Computed	Experimental
1	N6-Ru-N4	89.84	89.20
2	N6-Ru-N3	97.06	96.47
3	N6-Ru-N5	78.44	78.88
4	N4-Ru-N3	78.44	79.21
5	N4-Ru-N5	98.45	100.60
6	N3-Ru-N5	174.61	175.35
7	N6-Ru-N8	173.26	172.98
8	N4-Ru-N8	95.45	95.51
9	N3-Ru-N8	88.08	89.54
10	N5-Ru-N8	96.63	95.10
11	N6-Ru-N1	97.23	97.48
12	N4-Ru-N1	171.38	170.99
13	N3-Ru-N1	95.75	93.97
14	N5-Ru-N1	87.80	86.67
15	N8-Ru-N1	77.85	78.42