Geometry & MOs

Info

ID:	191124
PubChem CID:	78107802
Reduced:	OS2N5C25H27 (1)
Stoich.:	AB2C5D25E27 (1)
Weight, g/mol:	463.167811
ΔH_f, kcal/mol:	67.74
Dipole, Da:	9.25
IP(EA), eV:	-8.42(-1.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[3-[3-[4-(2-methoxyethyl)piperazin-1-yl]phenyl]benzimidazol-5-yl]methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CCCCN1CCN(CC1)C2=CC=C(C=C2)N3C=NC4=C3C=C(C=C4)C=C5C(=O)NC(=S)S5

DOS

IR

Vibrations