Geometry & MOs

Info

ID:	122707
PubChem CID:	50818060
Reduced:	ClO2N5C23H24 (1)
Stoich.:	AB2C5D23E24 (1)
Weight, g/mol:	482.172083
ΔH_f, kcal/mol:	14.13
Dipole, Da:	6.39
IP(EA), eV:	-8.2(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-chlorophenoxy)-N-methyl-N-[2-[5-[4-(pyrrolidine-1-carbonyl)phenyl]-1,2,4-oxadiazol-3-yl]ethyl]propanamide

Drug info:

PubChemData

Smile

CN(C)C1=CC=CC(=C1)C(=O)NC(=NCC2=CC=CC=N2)NC3=C(C=CC(=C3)Cl)OC

DOS

IR

Vibrations