Geometry & MOs

Info

ID:	142419
PubChem CID:	53031625
Reduced:	O3N4C29H30 (1)
Stoich.:	A3B4C29D30 (1)
Weight, g/mol:	465.156767
ΔH_f, kcal/mol:	-49.98
Dipole, Da:	5.01
IP(EA), eV:	-8.34(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[5-[5-[1-(3-chlorophenoxy)ethyl]-1,2,4-oxadiazol-3-yl]benzimidazol-1-yl]-1-pyrrolidin-1-ylpropan-1-one

Drug info:

PubChemData

Smile

CN(C)C1=CC=C(C=C1)CNC(=O)C2=CC=C(C=C2)CN3C4=CC=CC=C4C(=O)N5CCCC5C3=O

DOS

IR

Vibrations